121 SMILES Strings for Tyrosine-protein kinase BTK [328-659]

Compound Name
SMILES String
OCc1c(cccc1-c1ccnc2[nH]c(nc12)-c1cccnc1)N1CCOc2cc(cc(F)c2C1=O)C1CC1
Cc1c(NC(=O)c2ccc(cc2)C(C)(C)C)cccc1-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(=O)N1CCOCC1
OCc1c(cccc1-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(=O)N1CCOCC1)N1CCc2cc(ccc2C1=O)C1CC1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cc(F)cc(N2CCn3c4CC(C)(C)Cc4cc3C2=O)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccnc(N2CCn3c4CC(C)(C)Cc4cc3C2=O)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cnc(CNC(=O)c2nnc(o2)C(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)CCCC(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)C2CCC(CC2)C(C)(C)C)c(F)c1 |(7.1,-4.87,;5.85,-5.78,;4.39,-5.3,;3.48,-6.54,;4.39,-7.79,;5.85,-7.32,;1.94,-6.54,;1.04,-5.3,;-.43,-5.78,;-1.76,-5,;-3.1,-5.78,;-3.1,-7.31,;-1.76,-8.08,;-.43,-7.31,;1.04,-7.79,;-1.76,-3.47,;-3.1,-2.69,;-3.1,-1.15,;-1.76,-.38,;-1.76,1.15,;-.43,1.93,;-.43,3.47,;.91,4.23,;-1.76,4.23,;-1.76,5.78,;-3.1,6.54,;-4.43,5.78,;-4.43,4.23,;-3.1,3.47,;-5.76,6.54,;-5.76,8.08,;-7.1,5.78,;-7.1,7.31,;-.43,-1.15,;.91,-.38,;-.43,-2.69,)|
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)CCCC2CCCC2)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(OC(F)(F)F)cc2)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2cnc(o2)C2CC2)c(F)c1
COc1ccc(nc1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
CCn1cc(cn1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)CCC(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2csc(n2)C(F)(F)F)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)CCOC(C)(C)C)c(F)c1
CC(C)(C)c1nnc(o1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CC1
CC(C)(C)c1ccc(cn1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CC1
CC(C)(C)c1ccc(cc1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CC1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CC1
CC(C)(C)c1noc(n1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CC1
CC(C)(C)c1cc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CCNC(=O)C1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CCNC(=O)C1
CC(C)(C)c1noc(n1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1CCNC(=O)C1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CO)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CN2CCOc3cc(cc(F)c3C2=O)C2CC2)c(F)c1
CN1CCN(Cc2ccc(nc2)-c2nc3c(ccnc3[nH]2)-c2cccc(N3CCOc4cc(cc(F)c4C3=O)C3CC3)c2CO)CC1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cc(F)cc(N2CCOc3cc(cc(F)c3C2=O)C2CC2)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CN2CCOc3cc(cc(F)c3C2=O)C2CC2)cc1CO
CN(C)c1ccc(cc1)-c1nc2c(ccnc2[nH]1)-c1cccc(N2CCOc3cc(cc(F)c3C2=O)C2CC2)c1CO
COc1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CN2CCOc3cc(cc(F)c3C2=O)C2CC2)c(F)c1
CN(C)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1cccc(N2CCOc3cc(cc(F)c3C2=O)C2CC2)c1CO
Cn1cc(cn1)-c1nc2nccc(-c3cccc(N4CCOc5cc(cc(F)c5C4=O)C4CC4)c3CO)c2[nH]1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cccc(NC(=O)c2noc(n2)C(C)(C)C)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cccc(NC(=O)c2noc(n2)C2CC2)c1CO
CC(C)(C)c1nc(no1)C(=O)Nc1cccc(c1CO)-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(=O)N1CCOCC1
CC(C)(C)c1ccc(cc1)C(=O)Nc1cccc(c1CO)-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(=O)N1CCOCC1
C[C@H]1CN(C[C@@H](C)O1)c1ccc(cc1)-c1nc2c(ccnc2[nH]1)-c1cccc(NC(=O)c2noc(n2)C(C)(C)C)c1CO |r|
CC(C)(C)c1nc(no1)C(=O)Nc1cccc(c1CO)-c1ccnc2[nH]c(nc12)-c1ccc(cc1)N1CCC(F)(F)CC1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cccc(NC(=O)c2ccc(nc2)C2CC2)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cccc(NC(=O)c2cc3CCCCc3s2)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(c(F)c1)C1(CC1)NC(=O)N1CC(C1)OC(C)(C)C
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(cc1)C1(CC1)NC(=O)c1noc(n1)C(C)(C)C
CN(C)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(cc1)C1(CC1)NC(=O)c1ccc(cc1)C(C)(C)C
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)N2CC(C2)OC(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(nc2)C2CC2)c(F)c1
CN(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)N)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)C2CC(C2)OC(C)(C)C)c(F)c1 |(5.17,-2.72,;3.93,-3.62,;2.46,-3.15,;1.56,-4.39,;2.46,-5.64,;3.93,-5.16,;.02,-4.39,;-.89,-3.15,;-2.35,-3.62,;-3.69,-2.85,;-5.02,-3.62,;-5.02,-5.16,;-3.69,-5.93,;-2.35,-5.16,;-.89,-5.64,;-3.69,-1.31,;-2.35,-.54,;-2.35,1,;-3.69,1.77,;-3.69,3.31,;-2.35,4.08,;-1.02,3.31,;-1.02,1.77,;.31,4.08,;1.8,3.68,;2.2,5.16,;.71,5.56,;3.53,5.93,;4.87,5.16,;6.2,5.93,;4.87,3.62,;6.35,4.77,;-5.02,1,;-6.35,1.77,;-5.02,-.54,)|
CC1CC2(C1)CN(C2)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
COc1ccc(cc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(cc2)C(C)(C)C)c(F)c1
COc1ccc(cc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(cc2)C2CC2)c(F)c1
COc1ccccc1-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(cc2)C(C)(C)C)c(F)c1
CC(C)(C)c1ccc(cc1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C1=CCNCC1 |t:41|
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2cc(on2)C(C)(C)C)c(F)c1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(CCO)c1
CN1CCN(Cc2ccc(cc2)-c2nc3c(ccnc3[nH]2)-c2ccc(CNC(=O)c3noc(n3)C(C)(C)C)c(F)c2)CC1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(CCN)c1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cccc(OC(F)(F)F)c1
COc1ccnc(c1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)c1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccc(cn1)C(O)CO
Cc1cc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)cc1-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
COc1cccc(c1)-c1nc2c(ccnc2[nH]1)-c1cc(F)c(CNC(=O)c2noc(n2)C(C)(C)C)cc1C
CN1CCN(CC1)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)c1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccc(cn1)N1CCCC1
CC1CN(CC(C)O1)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)c1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccc(cn1)N1CCCCC1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccc(cn1)N1CCC(O)CC1
CN1CCC(=CC1)c1ccc(cc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)c1 |c:4|
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cccc(CNC(=O)c2noc(n2)C(C)(C)C)c1
Cc1c(CNC(=O)c2noc(n2)C(C)(C)C)cccc1-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
CN(C)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(cc2)C(C)(C)C)c(F)c1
CN(C)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)N2CC(C2)OC(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1cccc(NC(=O)N2CC(C2)OC(C)(C)C)c1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CN2Cc3cc(sc3C2=O)C(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CN2Cc3cc(sc3C2=O)C2CC2)c(F)c1
Cc1ccc(cc1)-n1ccn(-c2cccc(c2C)-c2ccnc3[nH]c(nc23)-c2ccc(cc2)C(=O)N2CCOCC2)c1=O
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(cc1)C1(CC1)NC(=O)c1nc(no1)C(C)(C)C
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(Cn2ncc3cc(cc(F)c3c2=O)C(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CN2CCc3cc(ccc3C2=O)C(C)(C)C)c(F)c1
Cc1cc(ccc1CNC(=O)C(N)=O)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(c(F)c1)C(C)(C)NC(=O)C(N)=O
Cc1cc(ccc1CNC(=O)c1nnc(o1)C(C)(C)C)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(c(F)c1)C(C)(C)NC(=O)c1nnc(o1)C(C)(C)C
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nc(no2)C(C)(C)C)cc1CO
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(c(F)c1)C(C)(C)NC(=O)c1ccc(cc1)C(C)(C)C
Cc1cc(ccc1CNC(=O)c1ccc(cc1)C(C)(C)C)-c1ccnc2[nH]c(nc12)-c1cnn(C)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(cc2)C(C)(C)C)c(c1)C(F)(F)F
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nnc(o2)C(C)(C)C)cc1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2ccc(cc2)C(C)(C)C)cc1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nnc(o2)C(C)(C)C)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(cc1)C1(CC1)NC(=O)c1ccc(cc1)C(C)(C)C
CC(C)(O)CCN1Cc2cc(ccc2C1=O)-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(=O)N1CCOCC1
CC(C)(C)c1ccc2C(=O)N(Cc3ccc(cc3)-c3ccnc4[nH]c(nc34)-c3ccc(cc3)C(=O)N3CCOCC3)CCc2c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)c1
CC(C)(C)c1ccc(cc1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(=O)N1CCOCC1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(CCN2CCOCC2)c1
CC(C)(C)c1nnc(o1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(CCN2CCOCC2)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(cc1)C1CCCN1C(=O)c1ccc(cc1)C(C)(C)C
Fc1cc(ccc1CNC(=O)c1nnc(o1)C1CCOCC1)-c1ccnc2[nH]c(nc12)-c1cnn(CCN2CCOCC2)c1
CC(C)(C)c1noc(n1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(c1)C1CCOCC1
CC(C)(C)c1nnc(s1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(c1)C1COC1
CC(C)(C)c1nnc(o1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(c1)C1CCOCC1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(c1)C1CCOCC1
CC(C)(C)c1nc(no1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cnn(c1)C1COC1
CCn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2cc3CCCCc3s2)c(F)c1
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2cc3CCCCc3s2)c(F)c1
CC(C)(C)c1noc(n1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1=CCNCC1 |t:33|
CN1CCC(=CC1)c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nnc(o2)C(C)(C)C)c(F)c1 |c:4|
CC(C)(C)c1nnc(o1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1=CCNCC1 |t:33|
CC(C)c1nnc(o1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)C1=CCNCC1 |t:32|
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2cc(no2)C(C)(C)C)c(F)c1
CN(C)c1ccc(cc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2noc(n2)C(C)(C)C)c(F)c1
CN(C)c1ccc(nc1)-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nc(no2)C(C)(C)C)c(F)c1
CC(C)(C)c1noc(n1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1cccnc1
CC(C)(C)c1noc(n1)C(=O)NCc1ccc(cc1F)-c1ccnc2[nH]c(nc12)-c1ccncc1
COc1ncccc1-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nc(no2)C(C)(C)C)c(F)c1
COc1cccnc1-c1nc2c(ccnc2[nH]1)-c1ccc(CNC(=O)c2nc(no2)C(C)(C)C)c(F)c1
Cc1c(NC(=O)c2ccc(cc2)C(C)(C)C)cccc1-c1ccnc2[nH]c(nc12)-c1ccc(cc1)C(O)=O
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc2CCN(Cc2c1)C(=O)c1nc(no1)C(C)(C)C
Cn1cc(cn1)-c1nc2c(ccnc2[nH]1)-c1ccc2CN(Cc2c1)C(=O)c1nc(no1)C(C)(C)C