112 SMILES Strings for Lysine--tRNA ligase

Compound Name
SMILES String
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccccc1\C=C\C(=O)OC(C)(C)C)C(=O)OCC |c:5,10|
COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)N(=O)=O)C(=O)OC\C=C\c1ccccc1 |c:7,12|
COC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)N(=O)=O)C(=O)OC(C)(C)CN(C)CCC(c1ccccc1)c1ccccc1 |c:4,9|
CC(C)OC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)N(=O)=O)C(=O)OC1CN(C1)C(c1ccccc1)c1ccccc1 |c:6,11|
COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1N(=O)=O)C(=O)OCC(C)C |c:4,9|
COC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)N(=O)=O)C(=O)OC1CCCN(Cc2ccccc2)C1 |c:4,9|
COC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)N(=O)=O)C(=O)OCCN1CCN(CC1)C(c1ccccc1)c1ccccc1 |c:4,9|
CN1CCCC(CC1)n1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O
Nc1ncnc2n(C[C@H]3CCCN3S(=O)(=O)C=C)cc(-c3ccc4OCOc4c3)c12 |r|
C[C@H]1CCC[C@@H](O1)C[C@H]2Cc3cc(cc(c3C(=O)O2)O)O
C[C@H]1CCC[C@@H](O1)C[C@@H]2Cc3cc(cc(c3C(=O)O2)O)O
C[C@@H]1CCC[C@H](O1)C[C@H]2Cc3cc(cc(c3C(=O)O2)O)O
[H][C@@]1(C[C@@H]2Cc3cc(O)cc(O)c3C(=O)O2)CCC[C@H](C)O1 |r|
[H][C@@]1(C[C@@H]2Cc3cc(O)cc(O)c3C(=O)O2)CCC[C@@H](C)O1 |r|
[H][C@@]1(C[C@H]2Cc3cc(O)cc(O)c3C(=O)O2)CCC[C@H](C)O1 |r|
C[C@@H]1CCC[C@@H](O1)C[C@H]2Cc3cc(cc(c3C(=O)O2)O)O
C[C@@H]1CCC[C@@H](O1)C[C@@H]2Cc3cc(cc(c3C(=O)O2)O)O
COc1cc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc(OC)c1OC
COCCCNc1nc(nc2COCc12)N1CCC(C1)NC(=O)c1ccc(cn1)C(O)=O
COc1ccc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc1
Cc1ccc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc1
OC(=O)c1ccc(nc1)C(=O)NC1CCN(C1)c1nc2COCc2c(NC2CCCCC2)n1
COC(=O)c1ccc(cc1)C(=O)NC1CCN(C1)c1nc2CCCc2c(Nc2ccc(OC)c(OC)c2)n1
COc1ccc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc1OC
OC(=O)c1ccc(nc1)C(=O)NC1CCN(C1)c1nc2COCc2c(Nc2ccc3OCCOc3c2)n1
CCc1ccc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc1
Cc1ccc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc1C
CCCCCCNc1nc(nc2COCc12)N1CCC(C1)NC(=O)c1ccc(cn1)C(O)=O
CCCCCNc1nc(nc2COCc12)N1CCC(C1)NC(=O)c1ccc(cn1)C(O)=O
CCOCCCNc1nc(nc2COCc12)N1CCC(C1)NC(=O)c1ccc(cn1)C(O)=O
COc1ccc(Nc2nc(nc3CCCc23)N2CCC(C2)NC(=O)c2ccc(cc2)C(O)=O)cc1OC
COc1cc(Nc2nc(nc3COCc23)N2CCC(C2)NC(=O)c2ccc(cn2)C(O)=O)cc(OC)c1
CCCCCCCNc1nc(nc2COCc12)N1CCC(C1)NC(=O)c1ccc(cn1)C(O)=O
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(C)C(O)=O)C(C)(C)O |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(CC(=O)OC)C(O)=O)C(C)(C)O |r|
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(C)C(O)=O)C(C)C |r|
[H][C@@]12CCc3cc(C(C)C)c(O)cc3[C@@]1(C)CCC[C@@]2(C)C=O |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(CC(=O)OC)C(O)=O)C(C)=O |r|
[H][C@@]12CCc3cc(O)ccc3[C@@]1(C)CCC[C@@]2(CC(=O)OC)C(O)=O |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(CC(=O)OC)C(O)=O)C(C)=C |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@]2(CO)C(O)=O)C(C)=O |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@]2(CO)C(O)=O)C(C)=C |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(C)CO)C(C)C |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(CC(=O)OC)C(O)=O)C(C)C |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@]2(CO)C(O)=O)C(C)C |r|
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Cc1cnc(Nc2ccc(cc2)N2CCOCC2)nc1-c1cc2CN(CCc2o1)C(=O)CC#N
COc1cc(ccc1OCc2ccc(cc2)C3CC3)C4CN(C4)C(=O)c5cc(ccn5)COC[C@H](CO)O
CCC(C(O)=O)n1c2cc(F)c(F)cc2s\c1=N/C(=O)c1cccc(c1)C(F)(F)F
COc1ccc(CCN(Cc2ccc(cc2)C(O)=O)c2nc3cccnc3s2)cc1
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3nc(nc3c2C(N)=O)-c2ccccc2Cl)cc(OC)c1 |r|
COc1cccc(c1)-c1nc2c(C(N)=O)c(Nc3cc(OC)cc(OC)c3)nc(N[C@H]3CCCC[C@H]3N)n2n1 |r|
COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3nc(nc3c2C(N)=O)-c2ccccc2)cc(OC)c1 |r|
COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3c(nnc3c2C(N)=O)-c2ccccc2)cc(OC)c1 |r|
COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3ncnc3c2C(N)=O)cc(OC)c1 |r|
COc1cc(Nc2nc(N[C@H]3CCCC[C@H]3N)n3cnnc3c2C(N)=O)cc(OC)c1 |r|
COc1cc(Nc2nc(NCCCN)n3cnnc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nc(NCC(C)(C)N)n3cnnc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nc(NCCN)n3cnnc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nc(NCC(=O)OC(C)(C)C)n3cnnc3c2C(N)=O)cc(OC)c1
COc1cc(Nc2nc(NCCO)n3cnnc3c2C(N)=O)cc(OC)c1
NCCNc1ncc(C(N)=O)c(Nc2cccc(c2)C(F)(F)F)n1
CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
CN(C)c1ccc(cc1)-c1cc2ncccc2c(NCCCCN)n1
Cc1ccc2C(N=O)C(=O)N(Cc3cc(F)cc4COCOc34)c2c1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1ccc(cc1)N1CCN(C)CC1
CC(C)c1n[nH]c(Cl)c1-c1ccnc(Nc2ccc(cn2)N2CCC(CC2)N(C)C)n1
CC(C)c1[nH]nc(c1-c1ccnc(Nc2ccc(cn2)N2CCC(CC2)N(C)C)n1)C(F)(F)F
Nc1nc(Nc2ccc(cc2)[C@H]2CC[C@@H](CC2)N2CCOCC2)nn1-c1ccccn1 |r,wU:11.11,wD:14.18,(-9.05,.18,;-7.58,.64,;-7.09,2.1,;-5.55,2.08,;-4.8,3.43,;-3.26,3.44,;-2.48,2.12,;-.94,2.14,;-.18,3.48,;-.98,4.81,;-2.52,4.79,;1.35,3.5,;2.1,4.85,;3.65,4.86,;4.44,3.53,;3.68,2.19,;2.14,2.18,;5.97,3.55,;6.75,2.22,;8.29,2.23,;9.05,3.57,;8.27,4.9,;6.73,4.89,;-5.09,.62,;-6.35,-.28,;-6.36,-1.81,;-5.04,-2.59,;-5.05,-4.13,;-6.39,-4.89,;-7.72,-4.11,;-7.71,-2.57,)|
CN1C(=O)N(Cc2cnc(N)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
CC(C)C[C@H]1CN(CCN1)c1ccc(c(n1)C(=O)c1cccnc1N)C(F)(F)F |r|
Cc1ccnc(Nc2cccc(n2)-c2cccc(N)c2)c1
Cc1ccnc(Nc2cccc(n2)-c2cccc(CN)c2)c1
Cc1ccnc(Nc2cccc(n2)-c2cccc(CCN)c2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(NCCN)c2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(NCCO)c2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(NCCCN)c2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(c2)N2CCNCC2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(c2)N2CCC(N)C2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(c2)N2CCC(N)CC2)c1
Cc1ccnc(Nc2cccc(n2)-c2ccnc(c2)N2CCCNCC2)c1
FC(F)(F)c1ccnc(Nc2cccc(n2)-c2ccnc(c2)N2CCNCC2)c1
c1cc(cc(c1)N2CCNCC2)c3cccc(n3)Nc4cc(ccn4)C(F)(F)F
C1CN(CCN1)c1cc(ccn1)-c1cccc(Nc2cnccn2)n1
C1CN(CCN1)c1cccc(c1)-c1cccc(Nc2cnccn2)n1
Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1
CNc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1
Oc1ccc(CNc2cc(Nc3cnccn3)nc(c2)-c2ccnc(c2)N2CCNCC2)cc1
O=C(Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1)C1CCNCC1
CC(=O)N1CCC(CC1)C(=O)Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1
O=C(Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1)c1ccccc1
O=C(Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1)c1cccnc1
Cc1cc(C(=O)Nc2cc(Nc3cnccn3)nc(c2)-c2ccnc(c2)N2CCNCC2)n(C)n1
O=C(Cc1cccnc1)Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1
OC(=O)c1ccc(cc1)C(=O)Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1
Cc1ccnc(Nc2cccc(n2)-c2cccc(NCCN)c2)c1
OC(=O)c1ccc(cn1)C(=O)Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1
Cc1ccnc(Nc2cccc(n2)-c2cccnc2)c1
O=C(Nc1cc(Nc2cnccn2)nc(c1)-c1ccnc(c1)N1CCNCC1)c1cncnc1
CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)n(c(n4)Nc5ccccc5)C6CCCC6
COc1ccc(Nc2nc(nc3scnc23)-c2cccc(CO)c2)cc1OC
COc1ccc(Nc2nc(nc3scnc23)N2CCC(C2)C(=O)Nc2ccc(cc2)C(O)=O)nc1OC
COc1ccc(Nc2nc(nc3scnc23)N2CCCC(C2)C(=O)Nc2ccc(C(O)=O)c(O)c2)cc1OC
COc1ccc(Nc2nc(nc3scnc23)N2CCCC(C2)C(=O)Nc2ccc(nc2)C(O)=O)cc1OC
COc1ccc(Nc2nc(nc3scnc23)N2CCCC(C2)C(=O)NCCc2ccncc2)cc1OC
CNC(=O)c1ccc(NC(=O)c2cccc(c2)-c2nc(Nc3ccc(OC)c(OC)c3)c3ncsc3n2)cc1
CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|