168 SMILES Strings for Malignant T-cell-amplified sequence 1

Compound Name
SMILES String
CC(C)(OCc1cc(-c2ccccc2)n(Cc2cccc(Cl)c2)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccc(Cl)cc2)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(F)cc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccc(Cl)cc2Cl)n1)C(O)=O
OC(=O)COCc1cc(-c2ccc(Cl)cc2)n(Cc2ccc(Cl)cc2Cl)n1
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccccc2)n1)C(O)=O
CC(C)(OCc1cc(-c2ccccc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2ccccc2Cl)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(Cl)c2)n(Cc2ccccc2Cl)n1)C(O)=O
Cc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)(OCc1cc(-c2cccc(F)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(c2)C(F)(F)F)n(Cc2ccccc2Cl)n1)C(O)=O
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)(OCc1cc(C2CCCCC2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(C2CCCC2)n(Cc2ccccc2Cl)n1)C(O)=O
OC(=O)C1(CC1)OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccccc2Cl)n1
CC(C)(OCc1cc(-c2nccs2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccccc2F)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccccc2Cl)n1)C(N)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccncc2)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2ccccn2)n1)C(O)=O
CC(C)(OCc1cc(-c2ccc(Cl)cc2)n(Cc2cccnc2)n1)C(O)=O
CC(C)(OCc1cc(-c2ccsc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccs2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1F
CC(C)COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CCOc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)Oc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Br
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Br
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1C(C)C
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1C
CC(C)(OCc1cc(-c2cccc(OCC3CC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(OC(F)(F)F)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)Oc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1OC
CC(C)(OCc1cc(-c2cccc(OC3CCC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1N(C)C
CC(C)(OCc1cc(-c2cccc(OC3CC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(CN3CCOCC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
COc1cccc(c1)-c1cc(COC2(CCC2)C(O)=O)nn1Cc1ccccc1Cl
CC(C)(OCc1cc(-c2cccc(OCC3CCC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(OCC(F)(F)F)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(OCC3CCCC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(OCC3CCOCC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(c2)N2CCOCC2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cscn2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(c2)C#N)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cncs2)n(Cc2ccccc2Cl)n1)C(O)=O
CN(C)c1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)c1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
COCc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1
COc1cccc(c1)-c1c(C)c(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1-c1ccccc1
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1-c1ccccn1
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1-c1ccccc1Cl
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1-c1cccc(Cl)c1
COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1-c1ccc(Cl)cc1
CC(C)COc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1
COc1ccccc1Cn1nc(COC(C)(C)C(O)=O)cc1-c1cccc(OCC(C)C)c1
COc1cccc(Cn2nc(COC(C)(C)C(O)=O)cc2-c2cccc(OCC(C)C)c2)c1
COc1ccc(Cn2nc(COC(C)(C)C(O)=O)cc2-c2cccc(OCC(C)C)c2)cc1
COc1ccc(s1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
COc1csc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
COc1cc(cs1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CCC(CC)(OCc1cc(-c2cccc(OC)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CCC(C)(OCc1cc(-c2cccc(OC)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)C(=O)Nc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)(OCc1cc(-c2cccc(c2)S(C)(=O)=O)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(NS(C)(=O)=O)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CNc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)CNc1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)NC(=O)c1cccc(c1)-c1cc(COC(C)(C)C(O)=O)nn1Cc1ccccc1Cl
CC(C)(OCc1cc(Nc2ccccc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(Oc2ccccc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(Cc2ccccc2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(O)c2)n(Cc2ccccc2Cl)n1)C(O)=O
CC(C)(OCc1cc(-c2cccc(OCC3COC3)c2)n(Cc2ccccc2Cl)n1)C(O)=O
COc1cccc(c1)-c1cc(COC(C)(C)C(=O)NS(C)(=O)=O)nn1Cc1ccccc1Cl
COC(=O)C(C)(C)OCc1cc(-c2cccc(OC)c2)n(Cc2ccccc2Cl)n1
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cccc(CO)c3F)c2c(=O)n(C)c1=O |(-4.16,-5.55,;-4.16,-4.01,;-5.5,-3.24,;-2.83,-3.24,;-2.83,-1.7,;-1.49,-.93,;-.03,-1.41,;.88,-.16,;2.42,-.16,;3.19,-1.49,;2.71,-2.96,;1.38,-3.73,;3.96,-3.86,;5.2,-2.96,;4.73,-1.49,;5.5,-.16,;-.03,1.09,;.37,2.57,;-.72,3.66,;-.32,5.15,;1.17,5.55,;2.25,4.46,;3.74,4.86,;4.83,3.77,;1.86,2.97,;2.95,1.88,;-1.49,.61,;-2.83,1.38,;-2.83,2.92,;-4.16,.61,;-5.5,1.38,;-4.16,-.93,;-5.5,-1.7,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(C)cc(CO)c3F)c2c(=O)n(C)c1=O |(-4.16,-5.89,;-4.16,-4.35,;-5.5,-3.58,;-2.83,-3.58,;-2.83,-2.04,;-1.49,-1.27,;-.03,-1.75,;.88,-.5,;2.42,-.5,;3.19,-1.84,;2.71,-3.3,;1.38,-4.07,;3.96,-4.21,;5.2,-3.3,;4.73,-1.84,;5.5,-.5,;-.03,.74,;.37,2.23,;-.72,3.32,;-.32,4.81,;-1.41,5.89,;1.17,5.2,;2.25,4.12,;3.74,4.51,;4.83,3.42,;1.86,2.63,;2.95,1.54,;-1.49,.27,;-2.83,1.04,;-2.83,2.58,;-4.16,.27,;-5.5,1.04,;-4.16,-1.27,;-5.5,-2.04,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3c(F)cc(F)c(CO)c3F)c2c(=O)n(C)c1=O |(-4.16,-6.29,;-4.16,-4.75,;-5.5,-3.98,;-2.83,-3.98,;-2.83,-2.44,;-1.49,-1.67,;-.03,-2.15,;.88,-.9,;2.42,-.9,;3.19,-2.24,;2.71,-3.7,;1.38,-4.47,;3.96,-4.61,;5.2,-3.7,;4.73,-2.24,;5.5,-.9,;-.03,.34,;.37,1.83,;-.72,2.92,;-2.21,3.32,;-.32,4.41,;1.17,4.81,;1.56,6.29,;2.25,3.72,;3.74,4.12,;4.83,3.03,;1.86,2.23,;2.95,1.14,;-1.49,-.13,;-2.83,.64,;-2.83,2.18,;-4.16,-.13,;-5.5,.64,;-4.16,-1.67,;-5.5,-2.44,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cnc(F)c(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(F)c(F)c(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(CO)c(F)cc3F)c2c(=O)n(C)c1=O |(-4.16,-6.29,;-4.16,-4.75,;-5.5,-3.98,;-2.83,-3.98,;-2.83,-2.44,;-1.49,-1.67,;-.03,-2.15,;.88,-.9,;2.42,-.9,;3.19,-2.24,;2.71,-3.7,;1.38,-4.47,;3.96,-4.61,;5.2,-3.7,;4.73,-2.24,;5.5,-.9,;-.03,.34,;.37,1.83,;1.86,2.23,;2.25,3.72,;3.74,4.12,;4.83,3.03,;1.17,4.81,;1.56,6.29,;-.32,4.41,;-.72,2.92,;-2.21,3.32,;-1.49,-.13,;-2.83,.64,;-2.83,2.18,;-4.16,-.13,;-5.5,.64,;-4.16,-1.67,;-5.5,-2.44,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3ccc(F)c(CO)c3F)c2c(=O)n(C)c1=O |(-4.16,-6.29,;-4.16,-4.75,;-5.5,-3.98,;-2.83,-3.98,;-2.83,-2.44,;-1.49,-1.67,;-.03,-2.15,;.88,-.9,;2.42,-.9,;3.19,-2.24,;2.71,-3.7,;1.38,-4.47,;3.96,-4.61,;5.2,-3.7,;4.73,-2.24,;5.5,-.9,;-.03,.34,;.37,1.83,;-.72,2.92,;-.32,4.41,;1.17,4.81,;1.56,6.29,;2.25,3.72,;3.74,4.12,;4.83,3.03,;1.86,2.23,;2.95,1.14,;-1.49,-.13,;-2.83,.64,;-2.83,2.18,;-4.16,-.13,;-5.5,.64,;-4.16,-1.67,;-5.5,-2.44,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cncc(c3)C(O)C(F)(F)F)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3ccc(F)c(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3ccnc(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(F)cc(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cncc(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cccc(c3)C(C)O)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cccc(c3)C(O)C(F)(F)F)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cccc(CO)c3)c2c(=O)n(C)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3ccc(F)c(CO)c3)c2c(=O)n(C2CC2)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(C)cc(CO)c3F)c2c(=O)n(C2CC2)c1=O |(-3.39,-5.89,;-3.39,-4.35,;-4.73,-3.58,;-2.06,-3.58,;-2.06,-2.04,;-.72,-1.27,;.74,-1.75,;1.65,-.5,;3.19,-.5,;3.96,-1.84,;3.48,-3.3,;2.15,-4.07,;4.73,-4.21,;5.97,-3.3,;5.5,-1.84,;6.27,-.5,;.74,.74,;1.14,2.23,;.05,3.32,;.45,4.81,;-.64,5.89,;1.94,5.2,;3.02,4.12,;4.51,4.51,;5.6,3.42,;2.63,2.63,;3.72,1.54,;-.72,.27,;-2.06,1.04,;-2.06,2.58,;-3.39,.27,;-4.73,1.04,;-6.27,1.04,;-5.5,2.37,;-3.39,-1.27,;-4.73,-2.04,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(F)c(F)c(CO)c3)c2c(=O)n(C2CC2)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(CO)c(F)cc3F)c2c(=O)n(C2CC2)c1=O |(-3.39,-6.29,;-3.39,-4.75,;-4.73,-3.98,;-2.06,-3.98,;-2.06,-2.44,;-.72,-1.67,;.74,-2.15,;1.65,-.9,;3.19,-.9,;3.96,-2.24,;3.48,-3.7,;2.15,-4.47,;4.73,-4.61,;5.97,-3.7,;5.5,-2.24,;6.27,-.9,;.74,.34,;1.14,1.83,;2.63,2.23,;3.02,3.72,;4.51,4.12,;5.6,3.03,;1.94,4.81,;2.33,6.29,;.45,4.41,;.05,2.92,;-1.44,3.32,;-.72,-.13,;-2.06,.64,;-2.06,2.18,;-3.39,-.13,;-4.73,.64,;-6.27,.64,;-5.5,1.97,;-3.39,-1.67,;-4.73,-2.44,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cccc(CO)c3F)c2c(=O)n(C2CC2)c1=O |(-3.39,-5.55,;-3.39,-4.01,;-4.73,-3.24,;-2.06,-3.24,;-2.06,-1.7,;-.72,-.93,;.74,-1.41,;1.65,-.16,;3.19,-.16,;3.96,-1.49,;3.48,-2.96,;2.15,-3.73,;4.73,-3.86,;5.97,-2.96,;5.5,-1.49,;6.27,-.16,;.74,1.09,;1.14,2.57,;.05,3.66,;.45,5.15,;1.94,5.55,;3.02,4.46,;4.51,4.86,;5.6,3.77,;2.63,2.97,;3.72,1.88,;-.72,.61,;-2.06,1.38,;-2.06,2.92,;-3.39,.61,;-4.73,1.38,;-6.27,1.38,;-5.5,2.71,;-3.39,-.93,;-4.73,-1.7,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3ccc(F)c(CO)c3F)c2c(=O)n(C2CC2)c1=O |(-3.39,-6.29,;-3.39,-4.75,;-4.73,-3.98,;-2.06,-3.98,;-2.06,-2.44,;-.72,-1.67,;.74,-2.15,;1.65,-.9,;3.19,-.9,;3.96,-2.24,;3.48,-3.7,;2.15,-4.47,;4.73,-4.61,;5.97,-3.7,;5.5,-2.24,;6.27,-.9,;.74,.34,;1.14,1.83,;.05,2.92,;.45,4.41,;1.94,4.81,;2.33,6.29,;3.02,3.72,;4.51,4.12,;5.6,3.03,;2.63,2.23,;3.72,1.14,;-.72,-.13,;-2.06,.64,;-2.06,2.18,;-3.39,-.13,;-4.73,.64,;-6.27,.64,;-5.5,1.97,;-3.39,-1.67,;-4.73,-2.44,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cc(CO)ccc3F)c2c(=O)n(C2CC2)c1=O |(-3.39,-5.55,;-3.39,-4.01,;-4.73,-3.24,;-2.06,-3.24,;-2.06,-1.7,;-.72,-.93,;.74,-1.41,;1.65,-.16,;3.19,-.16,;3.96,-1.49,;3.48,-2.96,;2.15,-3.73,;4.73,-3.86,;5.97,-2.96,;5.5,-1.49,;6.27,-.16,;.74,1.09,;1.14,2.57,;2.63,2.97,;3.02,4.46,;4.51,4.86,;5.6,3.77,;1.94,5.55,;.45,5.15,;.05,3.66,;-1.44,4.06,;-.72,.61,;-2.06,1.38,;-2.06,2.92,;-3.39,.61,;-4.73,1.38,;-6.27,1.38,;-5.5,2.71,;-3.39,-.93,;-4.73,-1.7,)|
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3ccnc(CO)c3)c2c(=O)n(C2CC2)c1=O
CC(C)Cn1c2sc(Cc3c(C)n[nH]c3C)c(-c3cccc(CO)c3)c2c(=O)n(C2CC2)c1=O
CC(C)Cc1nn(C)c(=O)c2c(-c3ncc(CO)s3)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3csc(CO)n3)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3ccc(F)c(CO)c3F)n(Cc3cccc4ccccc34)cc12 |(-5.32,-6.29,;-5.32,-4.75,;-6.65,-3.98,;-3.98,-3.98,;-3.98,-2.44,;-5.32,-1.67,;-5.32,-.13,;-6.65,.64,;-3.98,.64,;-3.98,2.18,;-2.65,-.13,;-1.18,.34,;-.79,1.83,;-1.88,2.92,;-1.48,4.41,;.01,4.81,;.41,6.29,;1.1,3.72,;2.59,4.12,;2.99,5.6,;.7,2.23,;1.79,1.14,;-.28,-.9,;1.26,-.9,;2.03,-2.24,;1.26,-3.57,;2.03,-4.9,;3.57,-4.9,;4.34,-3.57,;5.88,-3.57,;6.65,-2.24,;5.88,-.9,;4.34,-.9,;3.57,-2.24,;-1.18,-2.15,;-2.65,-1.67,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cc(CO)ccc3F)n(Cc3cccc4ccccc34)cc12 |(-5.32,-5.95,;-5.32,-4.41,;-6.65,-3.64,;-3.98,-3.64,;-3.98,-2.1,;-5.32,-1.33,;-5.32,.21,;-6.65,.98,;-3.98,.98,;-3.98,2.52,;-2.65,.21,;-1.18,.69,;-.79,2.18,;.7,2.57,;1.1,4.06,;2.59,4.46,;2.99,5.95,;.01,5.15,;-1.48,4.75,;-1.88,3.26,;-3.36,3.66,;-.28,-.56,;1.26,-.56,;2.03,-1.89,;1.26,-3.23,;2.03,-4.56,;3.57,-4.56,;4.34,-3.23,;5.88,-3.23,;6.65,-1.89,;5.88,-.56,;4.34,-.56,;3.57,-1.89,;-1.18,-1.8,;-2.65,-1.33,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3F)n(Cc3cccc4ccccc34)cc12 |(-5.32,-5.95,;-5.32,-4.41,;-6.65,-3.64,;-3.98,-3.64,;-3.98,-2.1,;-5.32,-1.33,;-5.32,.21,;-6.65,.98,;-3.98,.98,;-3.98,2.52,;-2.65,.21,;-1.18,.69,;-.79,2.18,;-1.88,3.26,;-1.48,4.75,;.01,5.15,;1.1,4.06,;2.59,4.46,;2.99,5.95,;.7,2.57,;1.79,1.49,;-.28,-.56,;1.26,-.56,;2.03,-1.89,;1.26,-3.23,;2.03,-4.56,;3.57,-4.56,;4.34,-3.23,;5.88,-3.23,;6.65,-1.89,;5.88,-.56,;4.34,-.56,;3.57,-1.89,;-1.18,-1.8,;-2.65,-1.33,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cc(CO)ccc3Cl)n(Cc3cccc4ccccc34)cc12 |(-5.32,-5.95,;-5.32,-4.41,;-6.65,-3.64,;-3.98,-3.64,;-3.98,-2.1,;-5.32,-1.33,;-5.32,.21,;-6.65,.98,;-3.98,.98,;-3.98,2.52,;-2.65,.21,;-1.18,.69,;-.79,2.18,;.7,2.57,;1.1,4.06,;2.59,4.46,;2.99,5.95,;.01,5.15,;-1.48,4.75,;-1.88,3.26,;-3.36,3.66,;-.28,-.56,;1.26,-.56,;2.03,-1.89,;1.26,-3.23,;2.03,-4.56,;3.57,-4.56,;4.34,-3.23,;5.88,-3.23,;6.65,-1.89,;5.88,-.56,;4.34,-.56,;3.57,-1.89,;-1.18,-1.8,;-2.65,-1.33,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cncc(CO)c3)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3csc(c3)C(C)O)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(n3)C(C)O)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cc(ccc3F)C(C)O)n(Cc3cccc4ccccc34)cc12 |(-5.32,-5.95,;-5.32,-4.41,;-6.65,-3.64,;-3.98,-3.64,;-3.98,-2.1,;-5.32,-1.33,;-5.32,.21,;-6.65,.98,;-3.98,.98,;-3.98,2.52,;-2.65,.21,;-1.18,.69,;-.79,2.18,;.7,2.57,;1.1,4.06,;.01,5.15,;-1.48,4.75,;-1.88,3.26,;-3.36,3.66,;2.59,4.46,;3.68,3.37,;2.99,5.95,;-.28,-.56,;1.26,-.56,;2.03,-1.89,;1.26,-3.23,;2.03,-4.56,;3.57,-4.56,;4.34,-3.23,;5.88,-3.23,;6.65,-1.89,;5.88,-.56,;4.34,-.56,;3.57,-1.89,;-1.18,-1.8,;-2.65,-1.33,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(c3)C(C)O)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3csc(n3)C(O)C(F)(F)F)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3csc(c3)C(O)C(F)(F)F)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3ccc(s3)C(O)C(F)(F)F)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(c3)C(O)C(F)(F)F)n(Cc3cccc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cc(CO)ccc3F)n(Cc3ccc(cc3)-c3ccccc3)cc12 |(-5.32,-4.64,;-5.32,-3.1,;-6.65,-2.33,;-3.98,-2.33,;-3.98,-.79,;-5.32,-.02,;-5.32,1.52,;-6.65,2.29,;-3.98,2.29,;-3.98,3.83,;-2.65,1.52,;-1.18,1.99,;-.79,3.48,;.7,3.88,;1.1,5.37,;2.59,5.77,;2.99,7.25,;.01,6.46,;-1.48,6.06,;-1.88,4.57,;-3.36,4.97,;-.28,.75,;1.26,.75,;2.03,-.59,;1.26,-1.92,;2.03,-3.25,;3.57,-3.25,;4.34,-1.92,;3.57,-.59,;4.34,-4.59,;3.57,-5.92,;4.34,-7.25,;5.88,-7.25,;6.65,-5.92,;5.88,-4.59,;-1.18,-.5,;-2.65,-.02,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(c3)C(C)O)n(Cc3ccc(cc3)-c3ccccc3)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3c(C)n[nH]c3C)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cc(CO)ccc3F)n(Cc3c(C)n[nH]c3C)cc12 |(-4.16,-5.95,;-4.16,-4.41,;-5.5,-3.64,;-2.83,-3.64,;-2.83,-2.1,;-4.16,-1.33,;-4.16,.21,;-5.5,.98,;-2.83,.98,;-2.83,2.52,;-1.49,.21,;-.03,.69,;.37,2.18,;1.86,2.57,;2.25,4.06,;3.74,4.46,;4.14,5.95,;1.17,5.15,;-.32,4.75,;-.72,3.26,;-2.21,3.66,;.88,-.56,;2.42,-.56,;3.19,-1.89,;4.73,-1.89,;5.5,-.56,;5.2,-3.36,;3.96,-4.26,;2.71,-3.36,;1.38,-4.13,;-.03,-1.8,;-1.49,-1.33,)|
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(c3)C(O)C(F)(F)F)n(Cc3c(C)n[nH]c3C)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cc(Cl)nc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cnc(Cl)c4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(CCOc3ccccc3Cl)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cc(NCN)nc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cnc(NCN)c4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cc(NCNC(C)=O)nc4ccccc34)cc12
CC(C)Cc1nn(C)c(=O)c2c(-c3cccc(CO)c3)n(Cc3cc(NCNC(=O)C(N)CCC(N)=O)nc4ccccc34)cc12
CC(C)Cn1c2nc(COc3cccc4ccccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4cnccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4ncccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cncc4ccccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4[nH]ccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3C(F)(F)F)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc([N+]([O-])=O)c4ccccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc(N)c4ccccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc4ccccc4c3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3Br)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccnc4ccccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3Cl)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc(cc3)-c3ccccc3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc(c3)C(F)(F)F)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3F)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc4ncccc4c3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc(Br)cc3Br)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc4cccnc4c3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc(Cl)cc3Br)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccc(cc3)C(F)(F)F)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3-c3ccccc3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cc(F)ccc3Br)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4ccncc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4cccnc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cc4ccccc4cn3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccncc3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3c(Br)cc(Br)c4cnccc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4nccnc34)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccnc3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc(c3)[N+]([O-])=O)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc(N)c3)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3ccccc3C#N)c(CCCCCO)nc2c(=O)n(C)c1=O
CC(C)Cn1c2nc(COc3cccc4ccccc34)c(CCc3ccccc3CO)nc2c(=O)n(C)c1=O
CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|