UCSF

ZINC20230179

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 32 No

Popular Name: (5R)-4-(4-bromobenzoyl)-1-(3-dimethylaminopropyl)-3-hydroxy-5-(4-isopropoxyphenyl)-5H-pyrrol-2-one (5R)-4-(4-bromobenzoyl)-1-(3-dim…

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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) 4.28 11.74 -69.31 1 6 0 74 501.421 9 ↓
Lo Low (pH 4.5-6) 4.28 10.91 -46.42 2 6 1 71 502.429 9 ↓

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