UCSF

ZINC40052584

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 31 No

Popular Name: (2S)-4-hydroxy-1-(3-hydroxypropyl)-3-(4-isobutoxy-3-methyl-benzoyl)-2-(3-pyridyl)-2H-pyrrol-5-one (2S)-4-hydroxy-1-(3-hydroxypropy…

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Annotations

Vendors

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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) 2.34 6.05 -65.56 1 7 -1 103 423.489 9 ↓
Lo Low (pH 4.5-6) 2.34 5.3 -19.82 2 7 0 100 424.497 9 ↓

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