UCSF

ZINC20133225

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 32 No

Popular Name: (5S)-1-(3-dimethylaminopropyl)-3-hydroxy-4-(3-methoxybenzoyl)-5-(3-nitrophenyl)-5H-pyrrol-2-one (5S)-1-(3-dimethylaminopropyl)-3…

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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) 2.65 10.18 -74.85 1 9 0 120 439.468 9 ↓
Lo Low (pH 4.5-6) 2.65 9.35 -56.77 2 9 1 117 440.476 9 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )