UCSF

ZINC38601565

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 31 Yes

Popular Name: (3S)-3-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-4,5-dihydro-2-benzoxepin-1(3H)-one (3S)-3-[3-[(1E)-2-(7-Chloro-2-qu…

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CAS Number: 1100617-38-6

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.95 15.85 -13.78 0 3 0 39 425.915 3 ↓

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