82 SMILES Strings for Elongation of very long chain fatty acids protein 1

Compound Name
SMILES String
Fc1ccn(n1)[C@H]1C[C@@H](C1)c1cc(O[C@H]2C[C@H](C2)n2cccn2)ncn1 |r,wU:14.15,16.20,8.11,wD:6.6,(23.91,-32.68,;24.81,-31.43,;26.35,-31.43,;26.83,-29.97,;25.58,-29.06,;24.34,-29.97,;25.58,-27.52,;26.67,-26.43,;25.58,-25.35,;24.49,-26.43,;25.58,-23.81,;26.92,-23.04,;26.91,-21.49,;28.24,-20.72,;29.58,-21.48,;31.06,-21.07,;31.47,-22.56,;29.98,-22.96,;32.8,-23.32,;32.96,-24.85,;34.47,-25.16,;35.24,-23.83,;34.2,-22.68,;25.58,-20.73,;24.25,-21.5,;24.25,-23.04,)|
Fc1cnn(c1)[C@H]1C[C@@H](C1)c1cc(O[C@H]2C[C@H](C2)n2cccn2)ncn1 |r,wU:14.15,16.20,8.11,wD:6.6,(65.28,-33.26,;64.37,-32.01,;62.83,-32.01,;62.36,-30.55,;63.59,-29.64,;64.85,-30.55,;63.6,-28.1,;64.68,-27.02,;63.6,-25.94,;62.51,-27.02,;63.6,-24.4,;64.93,-23.62,;64.93,-22.07,;66.26,-21.3,;67.6,-22.06,;69.08,-21.65,;69.48,-23.14,;68,-23.54,;70.82,-23.9,;70.98,-25.43,;72.49,-25.74,;73.25,-24.41,;72.22,-23.27,;63.59,-21.31,;62.27,-22.08,;62.26,-23.63,)|
Clc1ccn(n1)[C@H]1C[C@@H](C1)c1cc(O[C@H]2C[C@H](C2)n2cccn2)ncn1 |r,wU:14.15,16.20,8.11,wD:6.6,(42.51,-33.26,;43.42,-32.01,;44.96,-32.01,;45.43,-30.55,;44.18,-29.64,;42.94,-30.55,;44.18,-28.1,;45.27,-27.02,;44.18,-25.94,;43.09,-27.02,;44.18,-24.4,;45.52,-23.62,;45.52,-22.07,;46.85,-21.3,;48.18,-22.06,;49.67,-21.65,;50.07,-23.14,;48.59,-23.54,;51.41,-23.9,;51.57,-25.43,;53.08,-25.74,;53.84,-24.41,;52.81,-23.27,;44.18,-21.31,;42.85,-22.08,;42.85,-23.63,)|
Fc1ccc(CCOc2cc(ncn2)N2CCCOCC2)cc1
C1[C@@H](C[C@@H]1n1cccn1)Oc1cc(ncn1)N1CCO[C@H](C1)c1ccccc1 |r,wU:1.10,3.4,wD:20.25,(31.82,-5.44,;30.33,-5.86,;30.73,-7.33,;32.22,-6.93,;33.56,-7.7,;34.96,-7.06,;35.99,-8.2,;35.23,-9.54,;33.72,-9.22,;29,-5.09,;27.67,-5.87,;27.67,-7.42,;26.33,-8.19,;25,-7.42,;25,-5.87,;26.33,-5.1,;26.33,-9.73,;25,-10.48,;24.99,-12.02,;26.32,-12.8,;27.66,-12.03,;27.67,-10.48,;28.99,-12.8,;28.98,-14.34,;30.3,-15.12,;31.64,-14.35,;31.64,-12.81,;30.31,-12.04,)|
Cc1ccnn1CCCOc1cc(ncn1)N1CCCCC1
Cc1ccnn1CCCOc1cc(ncn1)N1CCOC(C1)C(F)(F)F
Cc1ccnn1CCCOc1cc(ncn1)N1CCOC(C1)c1ccccc1
C1[C@@H](C[C@@H]1n1ccnn1)Oc1cc(ncn1)N1CCO[C@H](C1)c1ccccc1 |r,wU:1.10,3.4,wD:20.25,(78.16,-44.31,;76.67,-44.72,;77.07,-46.2,;78.56,-45.79,;79.9,-46.56,;81.3,-45.92,;82.34,-47.06,;81.57,-48.4,;80.07,-48.09,;75.34,-43.95,;74.01,-44.73,;74.01,-46.28,;72.67,-47.05,;71.34,-46.28,;71.34,-44.74,;72.67,-43.97,;72.67,-48.59,;71.34,-49.35,;71.33,-50.88,;72.66,-51.66,;74,-50.89,;74.01,-49.35,;75.33,-51.67,;75.32,-53.21,;76.64,-53.98,;77.98,-53.22,;77.98,-51.67,;76.65,-50.9,)|
C1[C@@H](C[C@@H]1c1ncco1)Oc1cc(ncn1)N1CCO[C@H](C1)c1ccccc1 |r,wU:1.10,3.4,wD:20.25,(10.83,-4.86,;9.34,-5.27,;9.74,-6.75,;11.23,-6.35,;12.57,-7.11,;12.73,-8.64,;14.23,-8.95,;15,-7.62,;13.96,-6.48,;8.01,-4.51,;6.67,-5.28,;6.68,-6.83,;5.34,-7.6,;4.01,-6.83,;4.01,-5.29,;5.34,-4.52,;5.34,-9.14,;4.01,-9.9,;4,-11.44,;5.33,-12.21,;6.67,-11.45,;6.68,-9.9,;8,-12.22,;7.98,-13.76,;9.31,-14.54,;10.65,-13.77,;10.65,-12.22,;9.32,-11.45,)|
C1[C@@H](C[C@@H]1c1nnco1)Oc1cc(ncn1)N1CCO[C@H](C1)c1ccccc1 |r,wU:1.10,3.4,wD:20.25,(48.73,-5.5,;47.25,-5.91,;47.65,-7.39,;49.14,-6.99,;50.47,-7.75,;50.64,-9.28,;52.14,-9.59,;52.91,-8.25,;51.87,-7.11,;45.91,-5.14,;44.58,-5.92,;44.59,-7.47,;43.25,-8.24,;41.92,-7.47,;41.92,-5.93,;43.25,-5.16,;43.25,-9.78,;41.91,-10.54,;41.91,-12.07,;43.24,-12.85,;44.58,-12.08,;44.59,-10.54,;45.91,-12.86,;45.89,-14.4,;47.22,-15.17,;48.56,-14.41,;48.56,-12.86,;47.23,-12.09,)|
C1[C@@H](C[C@@H]1n1cccn1)Oc1cc(ncn1)[C@H]1C[C@@H](C1)n1cccn1 |r,wU:1.10,3.4,16.18,wD:18.23,(13.16,-20.32,;11.68,-20.73,;12.08,-22.21,;13.56,-21.8,;14.9,-22.57,;15.06,-24.09,;16.57,-24.41,;17.33,-23.07,;16.3,-21.93,;10.34,-19.96,;9.01,-20.74,;9.01,-22.29,;7.68,-23.06,;6.34,-22.29,;6.34,-20.74,;7.67,-19.97,;7.68,-24.6,;8.76,-25.68,;7.67,-26.77,;6.59,-25.68,;7.67,-28.31,;8.93,-29.21,;8.45,-30.68,;6.91,-30.68,;6.43,-29.21,)|
Fc1ccc(CCOc2cc(ncn2)N2CCOCC2)cc1
C1[C@@H](C[C@@H]1c1ccccc1)Oc1cc(ncn1)N1CCO[C@H](C1)c1ccccc1 |r,wU:1.11,3.4,wD:21.26,(60.2,-45.19,;58.72,-45.6,;59.12,-47.08,;60.61,-46.68,;61.94,-47.44,;61.94,-48.98,;63.27,-49.75,;64.61,-48.97,;64.59,-47.42,;63.26,-46.66,;57.38,-44.84,;56.05,-45.61,;56.06,-47.16,;54.72,-47.93,;53.38,-47.16,;53.39,-45.62,;54.72,-44.85,;54.72,-49.47,;53.38,-50.23,;53.38,-51.77,;54.71,-52.54,;56.05,-51.78,;56.05,-50.23,;57.38,-52.55,;57.36,-54.09,;58.69,-54.87,;60.03,-54.1,;60.03,-52.55,;58.7,-51.78,)|
CN(C)c1cc(OCCc2ccc(F)cc2)ncn1
CN(C1CCOC1)c1cc(OCCc2ccc(F)cc2)ncn1
Fc1ccc(CCOc2cc(ncn2)N2CCCCC2)cc1
Cc1ccnn1CCCOc1cc(ncn1)N1CCOC2(COC2)C1
Cc1ccnn1CCOc1cc(ncn1)N1CCCCC1
Cc1ccnn1CCCOc1cc(ncn1)N1CCOC(C1)c1ccnn1C
C1[C@@H](C[C@@H]1n1cccn1)Oc1cc(ncn1)[C@H]1C[C@H](C1)n1cccn1 |r,wU:1.10,3.4,16.18,18.23,(68.68,-5.68,;67.19,-6.09,;67.59,-7.57,;69.08,-7.16,;70.42,-7.93,;70.58,-9.46,;72.09,-9.77,;72.85,-8.43,;71.82,-7.29,;65.86,-5.32,;64.53,-6.1,;64.53,-7.65,;63.19,-8.42,;61.86,-7.65,;61.86,-6.11,;63.19,-5.33,;63.19,-9.96,;64.28,-11.04,;63.19,-12.13,;62.1,-11.04,;63.19,-13.67,;64.44,-14.57,;63.97,-16.04,;62.43,-16.04,;61.95,-14.57,)|
Fc1ccc(CCOc2cc(ncn2)N2CCCCCC2)cc1
Cc1ccnn1CCCOc1cc(ncn1)N1C2CC1COC2
Fc1ccc(CCOc2cc(ncn2)N2CCCC2)cc1
Fc1ccc(CCOc2cc(ccn2)N2CCCCC2)cc1
Fc1ccc(CCOc2ccc(cn2)-c2cccnc2)cc1
Fc1ccc(CCOc2cc(ccn2)-c2cccnc2)cc1
Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
O=C(Cc1ccccc1)Nc1nc(cs1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1nc(cs1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1ccn(n1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1cnn(c1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1cnn(n1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1ncn(n1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1ncc(o1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1ccnc(n1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1nccc(n1)-c1ccccc1
Fc1ccccc1CC(=O)Nc1cccc(n1)-c1ccccc1
O=C(Cc1ccccc1)Nc1ccn(n1)-c1ccccc1
C[C@@H](C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1 |r|
C[C@H](C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1 |r|
O=C(Nc1ccn(n1)-c1ccccc1)C1(CC1)c1ccccc1
CC[C@@H](C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1 |r|
CC(C)(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
CC1(C)CC1(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
FC1(F)CC1(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
CCOC(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
CN(C)C(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
O=C(Nc1ccn(n1)-c1ccccc1)C1(COC1)c1ccccc1
Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccccc1
Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccncc1
Cc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
COc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
Nc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccnc(c1)C(F)(F)F
Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccncn1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
Fc1ccc(cn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ncns1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2)n1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2Cl)n1
Cc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
COc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2C#N)n1
Fc1cccc(c1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
COc1cccc(c1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2cccc(c2)C#N)n1
Fc1ccc(cc1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccc(Cl)cc2)n1
COc1ccc(cc1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccc(cc2)C#N)n1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2c(F)cccc2F)n1
Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2cccc(F)c2F)n1
Fc1ccc(F)c(c1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
O=C(Nc1nc(cs1)-c1ccncc1)C1(CC1)c1ccccc1
Fc1cc(ccn1)-c1csc(NC(=O)Cc2ccccc2F)n1
O=C(Nc1nc(cs1)-c1ccccc1)C1CCCO1
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
Cc1[nH]n(-c2ccc(OC(F)(F)F)cc2)c(=O)c1C1(C(=O)N(C2=C1C(=O)CC(C)(C)C2)c1ccccc1)C(F)(F)F |c:24|
CC(C)Oc1ccc(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2N(C3)S(=O)(=O)c2cn(C)cn2)cc1 |r,TLB:9:11:18.17:14.15,THB:19:17:12.11:14.15|
Fc1ccc(cc1)C(=O)NC[C@]1(OC(=O)Nc2ccc(cc12)-c1cc[nH]n1)C(F)(F)F |r|
FC(F)(F)c1ccc(NC(=O)N2[C@@H]3CC[C@@H]2CC(C3)S(=O)(=O)c2ccccn2)cc1 |r,THB:19:17:11:13.14|