UCSF

ZINC20171449

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 34 No

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

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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) 2.28 10.13 -73.36 1 10 0 129 469.494 10 ↓
Lo Low (pH 4.5-6) 2.28 9.32 -57.34 2 10 1 126 470.502 10 ↓

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