Ibipinabant
FEATURES
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NAMES
  • BMS-646256
  • Ibipinabant
  • SLV-319
SMILES
CN/C(=N\S(=O)(=O)c1ccc(Cl)cc1)N1C[C@H](c2ccccc2)C(c2ccc(Cl)cc2)=N1
InChI
InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-11-19(25)12-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H,26,28)/t21-/m1/s1
MOLECULAR FORMULA
C23H20Cl2N4O2S
CROSS REFERENCES
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Ibipinabant
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight486.07
AlogP4.76
HBond donors1
HBond acceptors6
Atoms52
Contains toxicophoreNo
Contains PAINSNo
Commercially availableYes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Ibipinabant.