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Drug Details

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Name:CHEMBL12703
PubChem ID:17979744
Pathway:Show KEGG pathways
InChI:InChI=1S/C36H43N5O5S/c1-6-11-32-37-29-13-8-9-14-30(42)33(29)41(32)21-25-16-17-27(26(20-25)22-40-19-18-36(4,5)35(40)43)28-12-7-10-15-31(28)47(44,45)39-34-23(2)24(3)38-46-34/h7,10,12,15-17,20,39H,6,8-9,11,13-14,18-19,21-22H2,1-5H3
SMILES:CCCc1nc2c(n1Cc1ccc(c(c1)CN1CCC(C1=O)(C)C)c1ccccc1S(=O)(=O)Nc1onc(c1C)C)C(=O)CCCC2

Properties:
Formula:C36H43N5O5SAtoms:47
Molecular Weight:657.822Rotatable Bonds:10
H-bond Acceptors:10H-bond Donors:1
logP:7.7158
Targets:
NameUniprot IDSourceReferencesInteraction
Endothelin-1 receptorEDNRA_HUMANBindingDB-shows
Synonyms:
CHEBI:110300
CHEMBL12703