UCSF

ZINC17993506

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 28 No

Popular Name: (4E,5R)-4-[hydroxy-(p-tolyl)methylene]-5-(p-tolyl)-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione (4E,5R)-4-[hydroxy-(p-tolyl)meth…

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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) 3.69 9.63 -55.93 0 6 -1 86 390.444 4 ↓
Mid Mid (pH 6-8) 3.11 9.89 -11.43 0 6 0 80 391.452 4 ↓
Mid Mid (pH 6-8) 3.69 9.53 -14.37 1 6 0 83 391.452 4 ↓

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