UCSF

ZINC40047858

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 33 No

Popular Name: (2S)-3-(4-bromobenzoyl)-4-hydroxy-1-(3-hydroxypropyl)-2-(4-isobutoxy-3-methoxy-phenyl)-2H-pyrrol-5-o (2S)-3-(4-bromobenzoyl)-4-hydrox…

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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) 3.59 8.04 -57.19 1 7 -1 99 517.396 10 ↓
Lo Low (pH 4.5-6) 3.59 7.28 -15.22 2 7 0 96 518.404 10 ↓

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