49 SMILES Strings for Epidermal growth factor receptor [695-745,751-1022,T790M,C797S]

Compound Name
SMILES String
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1CC(C)(C)O
O=C(\N=c1/[nH]c2ccccc2n1C1CCCC1)c1ccnc(c1)-c1cccnc1
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1C1CCCC1
Cc1c(cnn1C)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1C1CCCC1
Cc1nn(C)cc1-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1C1CCCC1
CC(=O)N1CCC(CC1)c1ccc2n(C3CCCC3)\c(=N\C(=O)c3ccnc(c3)-c3cccnc3)[nH]c2c1
CC(=O)N1CCC(CC1)c1ccc2n(C3CCCC3)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1[C@H]1CC[C@@H](O)C1 |r|
CN1CCC(CC1)c1ccc2n(C3CCCC3)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
CN1CCC(CC1)c1ccc2n(C3CCCC3)\c(=N\C(=O)c3ccnc(c3)-c3cccnc3)[nH]c2c1
CC(C)Cn1c2ccccc2[nH]\c1=N/C(=O)c1ccnc(c1)-c1cnn(C)c1
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1[C@H]1CC[C@H](O)C1 |r|
CCCn1c2ccccc2[nH]\c1=N/C(=O)c1ccnc(c1)-c1cnn(C)c1
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1C1CCCCC1
Cc1c(cnn1C)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1CC(C)(C)O
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1C1CCC1
CCC(C)n1c2ccccc2[nH]\c1=N/C(=O)c1ccnc(c1)-c1cnn(C)c1
CN1CCC(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
CN1CCN(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
CC(C)(O)Cn1c2ccccc2[nH]\c1=N/C(=O)c1ccnc(c1)-c1cnn2ccccc12
CN1CCC(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3C)[nH]c2c1
CN1CCN(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3C)[nH]c2c1
CC(=O)N1CCC(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3C)[nH]c2c1
COc1ccncc1-c1cc(ccn1)C(=O)\N=c1/[nH]c2cc(ccc2n1CC(C)(C)O)C1CCN(C)CC1
CN(C)Cc1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
CN1CCC(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-n3cnc4cccc(F)c34)[nH]c2c1
COc1ccncc1-c1cc(ccn1)C(=O)\N=c1/[nH]c2cc(ccc2n1CC(C)(C)O)C1CCN(CC1)C(C)=O
CN1CCC(CC1)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn4cccnc34)[nH]c2c1
Cc1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
Cc1ccc2[nH]\c(=N/C(=O)c3ccnc(c3)-c3cnn(C)c3)n(CC(C)(C)O)c2c1
CN1CCC(CC1=O)c1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1[C@H]1CC[C@H](O)CC1 |r,wU:24.27,wD:27.31,(5.75,-2.98,;5.75,-1.44,;4.5,-.53,;4.98,.93,;6.52,.93,;6.99,-.53,;4.21,2.26,;2.67,2.26,;1.9,3.6,;2.67,4.93,;4.21,4.93,;4.98,3.6,;.36,3.6,;-.41,4.93,;-.41,2.26,;-1.95,2.26,;-2.86,3.51,;-4.32,3.03,;-5.66,3.8,;-6.99,3.03,;-6.99,1.49,;-5.66,.72,;-4.32,1.49,;-2.86,1.02,;-2.46,-.47,;-.97,-.87,;-.57,-2.36,;-1.66,-3.44,;-1.27,-4.93,;-3.15,-3.05,;-3.55,-1.56,)|
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1CCC(C)(C)O
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1CC(C)(C)CO
CC(C)(O)Cn1c2ccccc2[nH]\c1=N/C(=O)c1ccnc(c1)-n1cnc2ccccc12
CC(C)(O)Cn1c2ccc(cc2[nH]\c1=N/C(=O)c1ccnc(c1)-c1cccnc1)C1CCCOC1
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2cc(ccc2n1CC(C)(C)O)C1CCCOC1
COC(=O)Cc1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cccnc3)[nH]c2c1
COC(=O)Cc1ccc2n(CC(C)(C)O)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1
Cn1cc(cn1)-c1cc(cc(n1)C#N)C(=O)\N=c1/[nH]c2ccccc2n1[C@@H]1CC[C@H](O)CC1 |r,wU:26.29,29.33,(5.75,-4.31,;5.75,-2.77,;4.5,-1.87,;4.98,-.4,;6.52,-.4,;6.99,-1.87,;4.21,.93,;2.67,.93,;1.9,2.26,;2.67,3.6,;4.21,3.6,;4.98,2.26,;4.98,4.93,;5.75,6.27,;.36,2.26,;-.41,3.6,;-.41,.93,;-1.95,.93,;-2.86,2.18,;-4.32,1.7,;-5.66,2.47,;-6.99,1.7,;-6.99,.16,;-5.66,-.61,;-4.32,.16,;-2.86,-.32,;-2.46,-1.8,;-3.55,-2.89,;-3.15,-4.38,;-1.66,-4.78,;-1.27,-6.27,;-.57,-3.69,;-.97,-2.2,)|
Cc1cc(cc(n1)-c1cnn(C)c1)C(=O)\N=c1/[nH]c2ccccc2n1[C@@H]1CC[C@H](O)CC1 |r,wU:25.28,28.32,(4.98,5.6,;4.21,4.26,;2.67,4.26,;1.9,2.93,;2.67,1.6,;4.21,1.6,;4.98,2.93,;4.98,.26,;6.52,.26,;6.99,-1.2,;5.75,-2.11,;5.75,-3.65,;4.5,-1.2,;.36,2.93,;-.41,4.26,;-.41,1.6,;-1.95,1.6,;-2.86,2.84,;-4.32,2.37,;-5.66,3.14,;-6.99,2.37,;-6.99,.83,;-5.66,.06,;-4.32,.83,;-2.86,.35,;-2.46,-1.14,;-3.55,-2.22,;-3.15,-3.71,;-1.66,-4.11,;-1.27,-5.6,;-.57,-3.02,;-.97,-1.53,)|
CC(=O)N1CCC(CC1)c1ccc2n([C@@H]3CC[C@H](O)CC3)\c(=N\C(=O)c3ccnc(c3)-c3cnn(C)c3)[nH]c2c1 |r,wU:14.14,17.18,(-10.33,3.98,;-8.99,4.75,;-8.99,6.29,;-7.66,3.98,;-6.32,4.75,;-4.99,3.98,;-4.99,2.44,;-6.32,1.67,;-7.66,2.44,;-3.66,1.67,;-3.66,.13,;-2.32,-.64,;-.99,.13,;.47,-.34,;.87,-1.83,;-.22,-2.92,;.18,-4.41,;1.67,-4.81,;2.07,-6.29,;2.76,-3.72,;2.36,-2.23,;1.38,.9,;2.92,.9,;3.69,2.24,;2.92,3.57,;5.23,2.24,;6,3.57,;7.54,3.57,;8.31,2.24,;7.54,.9,;6,.9,;8.31,-.43,;9.85,-.43,;10.33,-1.9,;9.08,-2.8,;9.08,-4.34,;7.83,-1.9,;.47,2.15,;-.99,1.67,;-2.32,2.44,)|
Cn1cc(cn1)-c1cc(ccn1)C(=O)\N=c1/[nH]c2ccccc2n1C1CCCS(=O)C1
Cc1cc(cc(n1)-c1cnn(C)c1)C(=O)\N=c1/[nH]c2ccc(CN3CCOCC3)cc2n1C1CCCCC1
CN1CCN(Cc2ccc3[nH]\c(=N/C(=O)c4cc(C)nc(c4)-c4cnn(C)c4)n([C@@H]4CC[C@H](O)CC4)c3c2)CC1 |r,wU:29.30,32.34,(-9.97,-5.04,;-8.43,-5.04,;-7.66,-3.71,;-6.12,-3.71,;-5.35,-5.04,;-3.81,-5.04,;-3.04,-3.71,;-3.81,-2.37,;-3.04,-1.04,;-1.5,-1.04,;-.47,.11,;.93,-.52,;2.27,.25,;2.27,1.79,;.93,2.56,;3.6,2.56,;3.6,4.1,;4.94,4.87,;4.94,6.41,;6.27,4.1,;6.27,2.56,;4.94,1.79,;7.6,1.79,;9.07,2.26,;9.97,1.02,;9.07,-.23,;9.84,-1.56,;7.6,.25,;.77,-2.05,;1.86,-3.14,;1.46,-4.63,;2.55,-5.72,;4.04,-5.32,;5.13,-6.41,;4.44,-3.83,;3.35,-2.74,;-.73,-2.37,;-1.5,-3.71,;-6.12,-6.37,;-7.66,-6.37,)|
Cc1cc(cc(n1)-c1cnn(C)c1)C(=O)\N=c1/[nH]c2ccc(CN3CCOCC3)cc2n1[C@@H]1CC[C@H](O)CC1 |r,wU:32.36,35.40,(4.17,6.41,;4.17,4.87,;2.83,4.1,;2.83,2.56,;4.17,1.79,;5.5,2.56,;5.5,4.1,;6.83,1.79,;8.3,2.26,;9.2,1.02,;8.3,-.23,;9.07,-1.56,;6.83,.25,;1.5,1.79,;.16,2.56,;1.5,.25,;.16,-.52,;-1.24,.11,;-2.27,-1.04,;-3.81,-1.04,;-4.58,-2.37,;-3.81,-3.71,;-4.58,-5.04,;-6.12,-5.04,;-6.89,-3.71,;-8.43,-3.71,;-9.2,-5.04,;-8.43,-6.37,;-6.89,-6.37,;-2.27,-3.71,;-1.5,-2.37,;0,-2.05,;1.09,-3.14,;.69,-4.63,;1.78,-5.72,;3.27,-5.32,;4.36,-6.41,;3.67,-3.83,;2.58,-2.74,)|
CN1CCN(Cc2ccc3[nH]\c(=N/C(=O)c4cc(C)nc(c4)-c4cnn(C)c4)n(C4CCCCC4)c3c2)CC1
CN1CCC(CC1)c1ccc2[nH]\c(=N/C(=O)c3cc(C)nc(c3)-c3cnn(C)c3)n([C@@H]3CC[C@H](O)CC3)c2c1 |r,wU:30.32,33.36,(-9.66,-2.25,;-8.33,-1.48,;-8.33,.06,;-6.99,.83,;-5.66,.06,;-5.66,-1.48,;-6.99,-2.25,;-4.32,.83,;-4.32,2.37,;-2.99,3.14,;-1.66,2.37,;-.19,2.84,;.71,1.6,;2.25,1.6,;3.02,2.93,;2.25,4.26,;4.56,2.93,;5.33,4.26,;6.87,4.26,;7.64,5.6,;7.64,2.93,;6.87,1.6,;5.33,1.6,;7.64,.26,;9.18,.26,;9.66,-1.2,;8.41,-2.11,;8.41,-3.65,;7.17,-1.2,;-.19,.35,;.21,-1.14,;-.88,-2.22,;-.48,-3.71,;1,-4.11,;1.4,-5.6,;2.09,-3.02,;1.69,-1.53,;-1.66,.83,;-2.99,.06,)|
CC(C)(O)Cn1c2ccccc2[nH]\c1=N/C(=O)c1ccnc(c1)-c1cccnc1