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planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 2e3c3c2bd7ecdc9c2968a32f91e81136e0cb3835
author bgruening
date Mon, 05 Aug 2019 05:21:58 -0400
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children f56492688f43
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CN1CCC[C@H]1c2cccnc2
CN1CCC[C@H]1c2ccc[n+]([BH2-]C#N)c2
CN1CC[C@H]2CCc3ncccc3[C@@H]12
CN1CC[C@H]2CCc3c(ccc[n+]3[BH2-]C#N)[C@@H]12
CN1[C@@H](CC[C@H]1c2cccnc2)C#N
CN1[C@H](CC[C@H]1c2cccnc2)C#N
CN1CCC[C@H]1c2cncc(c2)C#C
CN1C[C@@H](Cc2ccccc2)C[C@H]1c3cccnc3
C[C@@H]1CC[C@H](N1C)c2cccnc2
C[C@H]1CC[C@H](N1C)c2cccnc2
CC[C@H]1C[C@H](N(C)C1)c2cccnc2
CN1C[C@@H](O)C[C@H]1c2cccnc2
CN1CCC(CO)[C@H]1c2cccnc2
CSC[C@H]1C[C@H](N(C)C1)c2cccnc2
CN1C[C@H](CO)C[C@H]1c2cccnc2
CN1C[C@@H](CC#N)C[C@H]1c2cccnc2
CN1C[C@@H](CF)C[C@H]1c2cccnc2
CO[C@H]1C[C@H](N(C)C1)c2cccnc2
CN1CCC(CF)[C@H]1c2cccnc2
CC1CCN(C)[C@@H]1c2cccnc2
COCC1CCN(C)[C@@H]1c2cccnc2
CN1C[C@@H](CO)C[C@H]1c2cccnc2
CN1C[C@H](C[C@H]1c2cccnc2)OC(=O)C
CN1C[C@@H](C[C@H]1c2cccnc2)C#N
CC1CN(C)[C@@H](C1C)c2cccnc2
C[C@H]1C[C@H](N(C)C1)c2cccnc2
CN1C[C@H](C[C@H]1c2cccnc2)OS(=O)(=O)C
COC[C@H]1C[C@H](N(C)C1)c2cccnc2
CCCC[C@@H]1CC[C@H](N1C)c2cccnc2
CCCC[C@H]1CC[C@H](N1C)c2cccnc2
CN1[C@@H](CC[C@H]1c2cccnc2)c3ccccc3
CN1[C@@H](CC[C@@H]1c2ccccc2)c3cccnc3
Clc1ccc(OC[C@H]2CN3C(=O)CC[C@@]3(O2)c4cccnc4)cc1
Clc1ccc(OC[C@@H]2CN3C(=O)CC[C@@]3(O2)c4cccnc4)cc1
CN1[C@@H](CCC1=O)c2cccnc2
CCCCCCCCC[n+]1cccc2[C@@H]3[C@@H](CCN3C)CCc12
CN1CCC[C@H]1c2ccc[n+](CCCCCCCCCCCCCC[n+]3cccc(c3)[C@@H]4CCCN4C)c2
CCCCCCCCCCCC[n+]1cccc2[C@@H]3[C@@H](CCN3C)CCc12
CCCCCCCCCCCC[n+]1cccc(c1)[C@@H]2CCCN2C
CCCCCCCCCC[n+]1cccc(c1)[C@@H]2CCCN2C
CN1CCC[C@H]1c2ccc[n+](CCCCCC[n+]3cccc(c3)[C@@H]4CCCN4C)c2
CN1CCC[C@H]1c2ccc[n+](CCCCCCCCCCC[n+]3cccc(c3)[C@@H]4CCCN4C)c2
CN1CCC[C@H]1c2ccc[n+](CCCCCCCC[n+]3cccc(c3)[C@@H]4CCCN4C)c2
CN1CCC[C@H]1c2ccc[n+](CCCCCCCCCC[n+]3cccc(c3)[C@@H]4CCCN4C)c2
CN1CCC[C@H]1c2ccc[n+](CCCCc3ccc(CCCC[n+]4cccc(c4)[C@@H]5CCCN5C)cc3)c2
CN1CCC[C@H]1c2ccc[n+](CCCCCc3ccccc3CCCCC[n+]4cccc(c4)[C@@H]5CCCN5C)c2
CN1CCC[C@H]1c2ccc[n+](CCCC#Cc3ccccc3C#CCCC[n+]4cccc(c4)[C@@H]5CCCN5C)c2
CN1CCC[C@H]1c2ccc[n+](CCCCCc3cc(CCCCC[n+]4cccc(c4)[C@@H]5CCCN5C)cc(CCCCC[n+]6cccc(c6)[C@@H]7CCCN7C)c3)c2
CN1CCC[C@H]1c2ccc[n+](CCCCCCCCC[n+]3cccc(c3)[C@@H]4CCCN4C)c2
CCCCCCCCCC[n+]1cccc2c1CC[C@]3(C)CCN(C)[C@]23C
CN1CCC[C@H]1c2ccc[n+](CCCC#Cc3cccc(c3)C#CCCC[n+]4cccc(c4)[C@@H]5CCCN5C)c2
CCCCCCCC[n+]1cccc2[C@@H]3[C@@H](CCN3C)CCc12
CN1CCC[C@H]1c2ccc[n+](CCCC#Cc3cc(cc(c3)C#CCCC[n+]4cccc(c4)[C@@H]5CCCN5C)C#CCCC[n+]6cccc(c6)[C@@H]7CCCN7C)c2
CCCCCCCCCCC[n+]1cccc2[C@@H]3[C@@H](CCN3C)CCc12
CCCCCCCCCC[n+]1cccc2[C@@H]3[C@@H](CCN3C)CCc12
C[N@+]1(CC[N@+]2(C)CCC[C@@H]2c3cccnc3)CCC[C@H]1c4cccnc4
CN1[C@@H](C[C@@H](OC2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)C1=O)c3cccnc3
CN1C(=O)CC[C@@]1(O)c2cccnc2
OCN1[C@@H](CCC1=O)c2cccnc2
CN1CCC[C@H]1c2ccc[n+](c2)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O
C[N+]1([O-])CCC[C@H]1c2cccnc2
CN1CCC[C@@]1(O)c2cccnc2
CN1[C@@H](CCC1=O)c2ccc[n+](C)c2
CN1[C@@H](CCC1=O)c2ccc[n+]([O-])c2
CN1[C@@H](CCC1=O)c2ccc[n+](c2)C3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)C
Cc1cncc(c1)[C@@H]2CCC[N+]2(C)[O-]
COc1ncc(cc1c2ncc(cc2[C@@H]3CC[C@H]4[C@H](OC(=O)N34)c5cc(cc(c5)C(F)(F)F)C(F)(F)F)C(F)(F)F)c6c(C)cc(cc6C)C(=O)O
COc1ccc(cc1c2ncc(cc2[C@@H]3CC[C@H]4[C@H](OC(=O)N34)c5cc(cc(c5)C(F)(F)F)C(F)(F)F)C(F)(F)F)c6c(C)cc(cc6C)C(=O)O
COc1ncc(cc1c2ncc(cc2[C@@H]3CC[C@H]4[C@H](OC(=O)N34)c5cc(cc(c5)C(F)(F)F)C(F)(F)F)C(F)(F)F)c6ccc(cc6C)C(=O)O
COCCOc1ncccc1[C@@H]2C(C(=O)C(C)C)C(=O)C(=O)N2c3ccc(cc3)c4ccsc4
COCCOc1ncccc1[C@@H]2C(C(=O)C(C)C)C(=O)C(=O)N2c3ccc(cc3)c4ccc(C)s4
O=S(=O)(Nc1ncns1)c2ccc3c(cccc3c2)N4CCC[C@H]4c5cccnc5