UCSF

ZINC00631332

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 37 No

Popular Name: (5R)-1-(5-carbethoxy-4-methyl-thiazol-2-yl)-5-(3,4-dimethoxyphenyl)-2-keto-4-p-toluoyl-3-pyrrolin-3- (5R)-1-(5-carbethoxy-4-methyl-th…

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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) 3.89 11.8 -41.22 0 9 -1 118 521.571 9 ↓
Mid Mid (pH 6-8) 4.34 0.7 -31.58 1 9 0 115 522.579 8 ↓
Mid Mid (pH 6-8) 3.31 0.99 -23.5 0 9 0 112 522.579 9 ↓

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