Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:CHEMBL212645
PubChem ID:16086064
Pathway:Show KEGG pathways
InChI:InChI=1S/C42H49F3N4O4/c43-32-13-7-29(8-14-32)42(30-9-15-33(44)16-10-30,31-11-17-34(45)18-12-31)25-39(51)49-27-36(50)24-38(49)41(53)48-21-3-6-37(48)40(52)46-26-28-19-22-47(23-20-28)35-4-1-2-5-35/h7-18,28,35-38,50H,1-6,19-27H2,(H,46,52)/t36-,37-,38+/m1/s1
SMILES:O[C@@H]1C[C@H](N(C1)C(=O)CC(c1ccc(cc1)F)(c1ccc(cc1)F)c1ccc(cc1)F)C(=O)N1CCC[C@@H]1C(=O)NCC1CCN(CC1)C1CCCC1

Properties:
Formula:C42H49F3N4O4Atoms:53
Molecular Weight:730.858Rotatable Bonds:13
H-bond Acceptors:8H-bond Donors:2
logP:5.7566
Targets:
Synonyms:
CHEBI:457747
CHEMBL212645