UCSF

ZINC40099030

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 27 No

Popular Name: (2S)-3-(2,4-dimethylthiazole-5-carbonyl)-4-hydroxy-1-(2-hydroxyethyl)-2-[(E)-styryl]-2H-pyrrol-5-one (2S)-3-(2,4-dimethylthiazole-5-c…

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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) 1.61 5.25 -57.71 1 6 -1 94 383.449 6 ↓
Lo Low (pH 4.5-6) 1.61 4.5 -13.1 2 6 0 91 384.457 6 ↓

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