SMILES for Lysine-specific histone demethylase 1A [151-852]

Cc1ccc(c(F)c1)-c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r,wD:14.14,(-6.52,-4.23,;-5.19,-3.46,;-5.19,-1.93,;-3.85,-1.15,;-2.52,-1.93,;-2.52,-3.46,;-1.18,-4.23,;-3.85,-4.23,;-1.18,-1.15,;-1.18,.38,;.15,1.15,;1.48,.38,;2.82,1.15,;4.15,.38,;5.48,1.15,;5.48,2.69,;6.95,3.17,;7.85,1.93,;6.95,.68,;1.48,-1.15,;2.63,-2.19,;2,-3.59,;.47,-3.43,;.15,-1.93,;-2.52,1.15,;-2.52,2.69,;-3.85,3.47,;-5.23,2.72,;-5.19,1.15,;-3.85,.38,;-6.57,3.49,;-7.9,4.26,)|

BDBM103895

CCC1CCC(=CC1)c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r,c:5|

BDBM103896

CC(C)(C)OC(=O)N1CCC(=CC1)c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r,c:10|

BDBM103897

Cn1ncc2cc(ccc12)-c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM103898

CN1C(=O)Cc2cc(ccc12)-c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM103899

N#Cc1ccc(cc1)-c1cc(OC[C@@H]2CCNC2)c2cncn2c1-c1ccc(cc1)N1CCOCC1 |r|

BDBM103900

CN1CCOc2cc(ccc12)-c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM103901

CN1CCOc2ccc(cc12)-c1c(cc(OC[C@@H]2CCNC2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM103988

N#Cc1ccc(cc1)-c1cc(OC[C@@H]2CCNC2)c2cncn2c1-c1ccc2OCCOc2c1 |r|

BDBM104007

N#Cc1ccc(cc1)-c1cc(OC[C@@H]2CCNC2)c2cncn2c1-c1ccc(CN2CCOCC2)cc1 |r|

BDBM104015

N#Cc1ccc(cc1)-c1cc(OC[C@@H]2CCNC2)c2cncn2c1-c1ccc(CCN2CCOCC2)cc1 |r|

BDBM104017

CN1CCN(Cc2ccc(cc2)-c2c(cc(OC[C@@H]3CCNC3)c3cncn23)-c2ccc(cc2)C#N)CC1 |r|

BDBM104019

CN1CC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3cncc23)C1 |r|

BDBM104040

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)n3cncc23)C1 |r|

BDBM104041

CN1C(=O)Cc2cc(ccc12)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104042

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)ncc4c3)n3cncc23)C1 |r|

BDBM104070

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)CCc4c3)n3cncc23)C1 |r|

BDBM104071

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)COc4c3)n3cncc23)C1 |r|

BDBM104072

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)n(C)c4c3)n3cncc23)C1 |r|

BDBM104073

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)n3cncc23)C1 |r|

BDBM104075

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)cnc4c3)n3cncc23)C1 |r|

BDBM104111

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4N(C)CCOc4c3)n3cncc23)C1 |r|

BDBM104112

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc4oc(=O)n(C)c4cc3F)n3cncc23)C1 |r,wD:5.5,(9.29,.9,;7.96,1.67,;7.96,3.21,;6.62,3.98,;5.29,3.21,;5.29,1.67,;3.96,.9,;2.62,1.67,;1.29,.9,;-.05,1.67,;-1.38,.9,;-2.71,1.67,;-2.71,3.21,;-4.05,3.98,;-5.43,3.24,;-5.38,1.67,;-4.05,.9,;-6.76,4.01,;-8.1,4.78,;-1.38,-.64,;-2.71,-1.41,;-4.05,-.64,;-5.38,-1.41,;-6.84,-.93,;-7.75,-2.18,;-9.29,-2.18,;-6.84,-3.42,;-7.61,-4.75,;-5.38,-2.95,;-4.05,-3.72,;-2.71,-2.95,;-1.38,-3.72,;-.05,-1.41,;.27,-2.91,;1.81,-3.07,;2.43,-1.67,;1.29,-.64,;6.62,.9,)|

BDBM104113

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4ncccc4c3)n3cncc23)C1 |r|

BDBM104114

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)nc(C)c4c3)n3cncc23)C1 |r|

BDBM104115

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4ncsc4c3)n3cncc23)C1 |r|

BDBM104116

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4scnc4c3)n3cncc23)C1 |r|

BDBM104117

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4sc(C)nc4c3)n3cncc23)C1 |r|

BDBM104118

CN1CCC[C@@H](COc2nc(-c3ccc(C#N)c(F)c3)c(-c3cnc4n(C)ncc4c3)n3cncc23)C1 |r|

BDBM104119

Cn1ncc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(CCO)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104120

Cn1ncc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(CCC#N)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104121

CC(O)CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)n3cncc23)C1 |r|

BDBM104122

COCCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)n3cncc23)C1 |r|

BDBM104123

Cn1ncc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(CC(C)(C)O)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104159

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(CO)c3)n3cncc23)C1 |r|

BDBM104160

COc1ncc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104161

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)n3cncc23)C1 |r|

BDBM104176

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)c(C)c3)n3cncc23)C1 |r|

BDBM104212

COC(=O)N(C)c1ccc(cc1)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104330

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(F)c(CO)c(F)c3)n3cncc23)C1 |r|

BDBM104351

COC(=O)N(C)Cc1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104657

COC(=O)N(C)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM104678

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)ncc3c2)n2cncc12

BDBM104681

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(=O)oc3c2)n2cncc12

BDBM104682

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)Cc3c2)n2cncc12

BDBM104918

COc1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM104923

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(nc2)N2CCCC2=O)n2cncc12

BDBM104925

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3cccnc3c2)n2cncc12

BDBM104926

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4nccnc4c3)n3cncc23)C1 |r|

BDBM104928

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)c(=O)oc4c3)n3cncc23)C1 |r|

BDBM104983

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)cnc4c3)n3cncc23)C1 |r|

BDBM104988

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4cccnc4c3)n3cncc23)C1 |r|

BDBM105030

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4ccoc4c3)n3cncc23)C1 |r|

BDBM105031

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCCc4c3)n3cncc23)C1 |r|

BDBM105055

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCOc4c3)n3cncc23)C1 |r|

BDBM105087

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)n3cncc23)C1 |r|

BDBM105122

CN1C(=O)Cc2cc(ccc12)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105127

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)COc4c3)n3cncc23)C1 |r|

BDBM105135

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)cnc4c3)n3cncc23)C1 |r|

BDBM105136

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCOc4c3)n3cncc23)C1 |r|

BDBM105149

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCCc4c3)n3cncc23)C1 |r|

BDBM105167

COc1ncc(cc1N)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105170

COc1ncc(cc1F)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105503

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)N3CCCC3=O)n3cncc23)C1 |r|

BDBM105507

COc1ccc(cn1)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105508

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cc(F)c(CO)c(F)c3)n3cncc23)C1 |r|

BDBM105512

COC(=O)N(C)c1ccc(cn1)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105513

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)n3cncc23)C1 |r|

BDBM105514

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(O)c3)n3cncc23)C1 |r|

BDBM105515

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(cc3)C(C)(C)O)n3cncc23)C1 |r|

BDBM105525

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc(N4CCOCC4)c(F)c3)n3cncc23)C1 |r|

BDBM105526

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(CO)c(C)c3)n3cncc23)C1 |r|

BDBM105530

CN(C)c1ccc(cn1)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105531

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(C)c3)n3cncc23)C1 |r|

BDBM105532

CN(C)C(=O)N(C)Cc1ccc(cc1F)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105533

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)cnc3c2)n2cncc12

BDBM105535

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)ccc3c2)n2cncc12

BDBM105539

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ccc4c3)n3cncc23)C1 |r|

BDBM105543

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(C)c3)n3cncc23)C1 |r|

BDBM105544

COC(=O)N(C)c1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105546

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(F)c3)n3cncc23)C1 |r|

BDBM105550

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(C)c2)n2cncc12

BDBM105551

COc1ncc(cc1F)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105552

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)c(CO)c2)n2cncc12

BDBM105553

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2CO)n2cncc12 |(8,3.08,;6.67,3.85,;6.67,5.39,;5.33,3.08,;5.33,1.54,;4,.77,;2.67,1.54,;2.67,3.08,;4,3.85,;1.33,.77,;,1.54,;-1.33,.77,;-2.67,1.54,;-2.67,3.08,;-4,3.85,;-5.33,3.08,;-5.33,1.54,;-4,.77,;-6.67,3.85,;-8,4.62,;-1.33,-.77,;-2.67,-1.54,;-4,-.77,;-5.33,-1.54,;-5.33,-3.08,;-6.67,-3.85,;-4,-3.85,;-2.67,-3.08,;-1.33,-3.85,;-1.33,-5.39,;,-1.54,;.32,-3.05,;1.85,-3.21,;2.48,-1.8,;1.33,-.77,)|

BDBM105555

COc1ncc(cc1C)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105557

COC(=O)N(C)c1ccc(cc1F)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105559

COC(=O)N(C)c1ccc(cc1)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105561

COC(=O)N(C)c1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105563

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(F)c2)n2cncc12

BDBM105564

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(OC(F)F)nc2)n2cncc12

BDBM105566

CCOc1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105573

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)ncc3c2)n2cncc12

BDBM105574

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CC(O)Cc4c3)n3cncc23)C1 |r|

BDBM105576

CN1CCC[C@@H](COc2nc(-c3ccc(C#N)c(F)c3)c(-c3ccc4N(C)C(=O)CCc4c3)n3cncc23)C1 |r|

BDBM105577

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3nccnc3c2)n2cncc12

BDBM105578

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3ccoc3c2)n2cncc12

BDBM105586

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3N(C)C(=O)COc3c2)n2cncc12

BDBM105587

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)OCc3c2)n2cncc12

BDBM105589

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)cnc3c2)n2cncc12

BDBM105590

CCn1c2ccc(cc2oc1=O)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105591

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(=O)n(C)c3c2F)n2cncc12 |(8,3.81,;6.67,4.58,;6.67,6.12,;5.33,3.81,;5.33,2.27,;4,1.5,;2.67,2.27,;2.67,3.81,;4,4.58,;1.33,1.5,;,2.27,;-1.33,1.5,;-2.67,2.27,;-2.67,3.81,;-4,4.58,;-5.33,3.81,;-5.33,2.27,;-4,1.5,;-6.67,4.58,;-8,5.35,;-1.33,-.04,;-2.67,-.81,;-4,-.04,;-5.33,-.81,;-5.33,-2.35,;-6.48,-3.38,;-7.97,-2.98,;-5.85,-4.79,;-6.62,-6.12,;-4.32,-4.63,;-3.23,-5.71,;-4,-3.12,;-2.67,-2.35,;-1.33,-3.12,;,-.81,;.32,-2.32,;1.85,-2.48,;2.48,-1.07,;1.33,-.04,)|

BDBM105596

CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)Cc4c3)n3cncc23)C1 |r|

BDBM105597

CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc4oc(=O)n(C)c4cc3F)n3cncc23)C1 |r,wD:6.6,(9.96,1.67,;8.62,.9,;7.29,1.67,;7.29,3.21,;5.96,3.98,;4.62,3.21,;4.62,1.67,;3.29,.9,;1.95,1.67,;.62,.9,;-.71,1.67,;-2.05,.9,;-3.38,1.67,;-3.38,3.21,;-4.71,3.98,;-6.05,3.21,;-6.05,1.67,;-4.71,.9,;-7.38,3.98,;-8.71,4.75,;-2.05,-.64,;-3.38,-1.41,;-4.71,-.64,;-6.05,-1.41,;-7.51,-.93,;-8.42,-2.18,;-9.96,-2.18,;-7.51,-3.42,;-8.28,-4.75,;-6.05,-2.95,;-4.71,-3.72,;-3.38,-2.95,;-2.05,-3.72,;-.71,-1.41,;-.39,-2.91,;1.14,-3.07,;1.77,-1.67,;.62,-.64,;5.96,.9,)|

BDBM105599

CN(C)[C@H]1CCN(C1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(=O)oc3c2)n2cncc12 |r|

BDBM105600

CN(C)[C@H]1CCN(C1)c1nc(-c2ccc(cc2)C#N)c(-c2cc3oc(=O)n(C)c3cc2F)n2cncc12 |r,wU:3.2,(5.05,5.51,;6.14,4.42,;7.63,4.82,;5.75,2.93,;6.65,1.69,;5.75,.44,;4.28,.92,;4.28,2.46,;2.95,.15,;1.61,.92,;.28,.15,;-1.05,.92,;-1.05,2.46,;-2.39,3.23,;-3.72,2.46,;-3.72,.92,;-2.39,.15,;-5.06,3.23,;-6.39,4,;.28,-1.39,;-1.05,-2.16,;-2.39,-1.39,;-3.72,-2.16,;-5.19,-1.69,;-6.09,-2.93,;-7.63,-2.93,;-5.19,-4.18,;-5.96,-5.51,;-3.72,-3.7,;-2.39,-4.47,;-1.05,-3.7,;.28,-4.47,;1.61,-2.16,;1.93,-3.67,;3.46,-3.83,;4.09,-2.42,;2.95,-1.39,)|

BDBM105611

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)Cc4c3)n3cncc23)C1 |r|

BDBM105630

COCCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCOc4c3)n3cncc23)C1 |r|

BDBM105653

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4N(C)CCOc4c3)n3cncc23)C1 |r|

BDBM105660

CCn1nnc2cc(cnc12)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105665

CC(O)CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCOc4c3)n3cncc23)C1 |r|

BDBM105667

CC(O)CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4ccoc4c3)n3cncc23)C1 |r|

BDBM105672

CC(O)CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4nccnc4c3)n3cncc23)C1 |r|

BDBM105686

COCCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4ccoc4c3)n3cncc23)C1 |r|

BDBM105693

COCCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4OCCCc4c3)n3cncc23)C1 |r|

BDBM105695

CC(O)c1ccc(cc1)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105728

CC(O)c1c(F)cc(cc1F)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105733

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(C)nc3)n3cncc23)C1 |r|

BDBM105736

CC(O)c1c(C)cc(cc1F)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105760

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(F)c3)n3cncc23)C1 |r|

BDBM105762

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)n3cncc23)C1 |r|

BDBM105764

COCCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)n3cncc23)C1 |r|

BDBM105777

COCCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(C)c3)n3cncc23)C1 |r|

BDBM105779

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(C)c3)n3cncc23)C1 |r|

BDBM105784

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)C(C)(C)C#N)n3cncc23)C1 |r|

BDBM105825

CCc1ccc(cn1)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105842

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnn(c3)C3CCC3)n3cncc23)C1 |r|

BDBM105876

CNC(=O)c1ccc(cn1)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM105877

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3CC(O)Cc3c2)n2cncc12

BDBM105878

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)CCc3c2)n2cncc12

BDBM105879

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc(F)c3n(C)c(=O)n(C)c3c2)n2cncc12

BDBM105880

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnn(c2)C2CCC2)n2cncc12

BDBM105893

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(c2)C(F)F)n2cncc12

BDBM105897

CNC(=O)c1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM105901

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(CO)c2)n2cncc12

BDBM105905

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(nc3c2)C(F)F)n2cncc12

BDBM105913

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3ccccc3c2)n2cncc12

BDBM105916

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3ncccc3c2)n2cncc12

BDBM105922

CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(C)nc3)n3cncc23)C1 |r|

BDBM106010

COCc1cc(cnc1C)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM106012

COc1ncc(cc1C#N)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM106019

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(CO)c(C)c2)n2cncc12

BDBM106024

COc1ncc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)c2cncn12)-c1ccc(cc1)C#N

BDBM106044

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)C(C)(C)O)n3cncc23)C1 |r|

BDBM106051

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4N(C)C(=O)COc4c3)n3cncc23)C1 |r|

BDBM106070

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(C)nc4c3)n3cncc23)C1 |r|

BDBM106085

CN1Cc2cc(ccc2C1=O)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM106086

CC(C)n1nnc2cc(cnc12)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM106087

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4n(nnc4c3)C3CC3)n3cncc23)C1 |r|

BDBM106093

CC(C)c1nc2cc(cnc2n1C)-c1c(cc(OC[C@@H]2CCCN(C)C2)c2cncn12)-c1ccc(cc1)C#N |r|

BDBM106143

CN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)c(nc4c3)C3CC3)n3cncc23)C1 |r|

BDBM111125

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111127

Cc1ccc(cc1)-c1c(nc(CCC2CCNC2)c2nccn12)-c1ccc(cc1)C#N

BDBM111151

Cc1ccc(cc1)-c1c(nc(CO[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111152

CN(C)[C@H]1CCN(Cc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1 |r|

BDBM111153

CN(C)[C@@H]1CCN(Cc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1 |r|

BDBM111154

CN(C)[C@@H]1CCN(CCc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1 |r|

BDBM111155

CN1CCC(C1)Oc1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111156

CN(C)CCCOc1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111157

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111158

Cc1ccc(cc1)-c1c(nc(OC[C@H]2CCCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111159

CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1 |r|

BDBM111160

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)n3ccnc23)C1 |r|

BDBM111161

Cc1ccc(cc1)-c1c(nc(SC[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111162

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111163

CN(C)CCCN(C)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111164

CN1CCCC1CCNc1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111165

CN1CCC(CC1)Nc1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111166

CN1CCCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111167

Cc1ccc(cc1)-c1c(nc(N2CCC3(CCNC3)C2)c2nccn12)-c1ccc(cc1)C#N

BDBM111168

Cc1ccc(cc1)-c1c(nc(N2CCC3(CNC3)CC2)c2nccn12)-c1ccc(cc1)C#N

BDBM111169

CN(C)[C@@H]1CCN(C1)C(=O)N(C)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12 |r|

BDBM111170

CN(C)[C@H]1CCN(C1)C(=O)N(C)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12 |r|

BDBM111171

Cc1ccc(cc1)-c1c(nc(NCCc2csc(N)n2)c2nccn12)-c1ccc(cc1)C#N

BDBM111172

Cc1ccc(cc1)-c1c(nc(C(=O)NCC2CNC2)c2nccn12)-c1ccc(cc1)C#N

BDBM111173

CN1CC(C1)NC(=O)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2)n2ccnc12

BDBM111174

N#Cc1ccc(cc1)-c1nc(OC[C@@H]2CCNC2)c2nccn2c1-c1ccccc1 |r|

BDBM111175

Clc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111176

FC(F)(F)c1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111177

N#Cc1ccc(cc1)-c1nc(OC[C@@H]2CCNC2)c2nccn2c1-c1ccc(cc1)N1CCCCC1 |r|

BDBM111178

COc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111179

CN(C)c1ncc(cn1)-c1c(nc(OC[C@@H]2CCNC2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111180

CN(C)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111181

Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111182

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(cn12)C(F)(F)F)-c1ccc(cc1)C#N |r|

BDBM111183

Cc1ccc(cc1)-c1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111184

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(CC#N)cn12)-c1ccc(cc1)C#N |r|

BDBM111185

CNC(=O)c1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111186

CN(C)C(=O)c1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111187

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(cn12)C(=O)NC1CC1)-c1ccc(cc1)C#N |r|

BDBM111188

CN1CC(C1)NC(=O)c1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111189

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(CO)cn12)-c1ccc(cc1)C#N |r|

BDBM111190

CN(C)Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111191

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(CN3CCC3)cn12)-c1ccc(cc1)C#N |r|

BDBM111192

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(CNCC3CC3)cn12)-c1ccc(cc1)C#N |r|

BDBM111193

Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCNC2)c2nc(CNc3ccon3)cn12)-c1ccc(cc1)C#N |r|

BDBM111194

CN(C)Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCN(C)C3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111195

CN(C)CCc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r|

BDBM111196

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)N3CCCC3=O)n3ccnc23)C1 |r|

BDBM111197

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)COc4c3)n3ccnc23)C1 |r|

BDBM111198

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4OCCOc4c3)n3ccnc23)C1 |r|

BDBM111199

CN(C)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111200

CN(CC1CCCO1)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111201

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ccc4c3)n3ccnc23)C1 |r|

BDBM111202

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)n3ccnc23)C1 |r|

BDBM111203

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4scnc4c3)n3ccnc23)C1 |r|

BDBM111204

CN(C)[C@H]1CCN(Cc2nc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)N3CCCC3=O)n3ccnc23)C1 |r|

BDBM111205

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(nc2)N2CCCC2=O)n2ccnc12

BDBM111206

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)ncc3c2)n2ccnc12

BDBM111207

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(=O)oc3c2)n2ccnc12

BDBM111208

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)COc3c2)n2ccnc12

BDBM111209

CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ccc4c3)n3ccnc23)C1 |r|

BDBM111210

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc3oc(=O)n(C)c3cc2F)n2ccnc12 |(8.62,2.83,;7.29,3.6,;7.29,5.14,;5.96,2.83,;5.96,1.29,;4.62,.52,;3.29,1.29,;3.29,2.83,;4.62,3.6,;1.95,.52,;.62,1.29,;-.71,.52,;-2.05,1.29,;-3.38,.52,;-4.71,1.29,;-4.71,2.83,;-3.38,3.6,;-2.05,2.83,;-6.05,3.6,;-7.38,4.37,;-.71,-1.02,;-2.05,-1.79,;-3.38,-1.02,;-4.71,-1.79,;-6.18,-1.31,;-7.08,-2.56,;-8.62,-2.56,;-6.18,-3.81,;-6.95,-5.14,;-4.71,-3.33,;-3.38,-4.1,;-2.05,-3.33,;-.71,-4.1,;.62,-1.79,;.94,-3.3,;2.47,-3.46,;3.1,-2.05,;1.95,-1.02,)|

BDBM111211

CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)n3ccnc23)C1 |r|

BDBM111212

Cn1c2ccc(cc2oc1=O)-c1c(nc(OC[C@@H]2CCCN(CCC#N)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111213

Cn1ncc2cc(ccc12)-c1c(nc(OC[C@@H]2CCCN(CCO)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111397

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)c(=O)oc3c2)n2ccnc12

BDBM111398

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(nc2)N2CCOC2=O)n2ccnc12

BDBM111399

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)nc(N)c3c2)n2ccnc12

BDBM111458

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(c3)C#N)n3ccnc23)C1 |r|

BDBM111562

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(CO)c3)n3ccnc23)C1 |r|

BDBM111777

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(CN4CCN(CC4)S(C)(=O)=O)c3)n3ccnc23)C1 |r|

BDBM111786

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)c(C)c3)n3ccnc23)C1 |r|

BDBM111793

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CCC(O)c4c3)n3ccnc23)C1 |r|

BDBM111795

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)cc3)n3ccnc23)C1 |r|

BDBM111796

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CCOCC4)cc3)n3ccnc23)C1 |r|

BDBM111798

COC(=O)N(C)c1cc(ccc1C)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111799

COC(=O)N(C)c1ccc(cc1)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM111800

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CC(O)Cc4c3)n3ccnc23)C1 |r|

BDBM111801

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc4C(O)CCc4c(F)c3)n3ccnc23)C1 |r|

BDBM111802

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4C(O)CCc4c3)n3ccnc23)C1 |r|

BDBM111803

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)n3ccnc23)C1 |r|

BDBM111804

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CCOCC4)c(F)c3)n3ccnc23)C1 |r|

BDBM111893

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(F)c(CO)c(F)c3)n3ccnc23)C1 |r|

BDBM112388

COc1ncc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM112389

COC(=O)N(C)Cc1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM112390

CC(O)c1ccc(cc1C)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM112391

CC(O)c1cc(ccc1C)-c1c(nc(OC[C@@H]2CCCN(C)C2)c2nccn12)-c1ccc(cc1)C#N |r|

BDBM112394

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc4CCC(O)c4c(F)c3)n3ccnc23)C1 |r|

BDBM112396

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CCOCC4)cc3F)n3ccnc23)C1 |r,wD:5.5,(10,.39,;8.67,1.16,;8.67,2.7,;7.34,3.47,;6,2.7,;6,1.16,;4.67,.39,;3.33,1.16,;2,.39,;.67,1.16,;-.67,.39,;-2,1.16,;-2,2.7,;-3.33,3.47,;-4.72,2.72,;-4.67,1.16,;-3.33,.39,;-6.05,3.49,;-7.38,4.26,;-.67,-1.16,;-2,-1.93,;-3.33,-1.16,;-4.67,-1.93,;-4.67,-3.47,;-6,-4.24,;-7.34,-3.47,;-7.34,-1.93,;-8.67,-1.16,;-10,-1.93,;-10,-3.47,;-8.67,-4.24,;-3.33,-4.24,;-2,-3.47,;-.67,-4.24,;.67,-1.93,;.99,-3.43,;2.52,-3.59,;3.15,-2.19,;2,-1.16,;7.34,.39,)|

BDBM112399

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3CO)n3ccnc23)C1 |r,wD:5.5,(8.67,1.15,;7.34,1.93,;7.34,3.47,;6,4.23,;4.67,3.47,;4.67,1.93,;3.33,1.15,;2,1.93,;.67,1.15,;-.67,1.93,;-2,1.15,;-3.33,1.93,;-3.33,3.47,;-4.67,4.23,;-6.05,3.49,;-6,1.93,;-4.67,1.15,;-7.38,4.26,;-8.72,5.03,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-6,-1.15,;-6,-2.69,;-7.34,-3.47,;-4.67,-3.47,;-3.33,-2.69,;-2,-3.47,;-2,-5,;-.67,-1.15,;-.35,-2.66,;1.18,-2.82,;1.81,-1.42,;.67,-.38,;6,1.15,)|

BDBM112400

CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(CC#N)c3)n3ccnc23)C1 |r|

BDBM112405

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(C)c2)n2ccnc12

BDBM112406

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3CC(O)Cc3c2)n2ccnc12

BDBM112407

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(O)c2)n2ccnc12

BDBM112412

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3CCC(O)c3c2)n2ccnc12

BDBM112416

CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)c(CO)c2)n2ccnc12