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Brevicompanine
FEATURES
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NAMES
  • BREVICOMPANINE
SMILES
C=CC(C)(C)[C@@]12C[C@H]3C(=O)N[C@H](C(C)C)C(=O)N3[C@@H]1Nc1ccccc12
InChI
InChI=1S/C21H27N3O2/c1-6-20(4,5)21-11-15-17(25)23-16(12(2)3)18(26)24(15)19(21)22-14-10-8-7-9-13(14)21/h6-10,12,15-16,19,22H,1,11H2,2-5H3,(H,23,25)/t15-,16+,19-,21+/m0/s1
MOLECULAR FORMULA
C21H27N3O2
CROSS REFERENCES
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Brevicompanine

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 353.21
AlogP 2.64
HBond donors 2
HBond acceptors 5
Atoms 53
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Brevicompanine.