UCSF

ZINC38591858

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 22 No

Popular Name: (5E)-1-(4-chlorophenyl)-5-[[(2R)-2H-pyrrol-2-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione (5E)-1-(4-chlorophenyl)-5-[[(2R)…

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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) 1.75 4.06 -39.69 0 5 -1 70 330.776 2 ↓
Lo Low (pH 4.5-6) 1.75 5.05 -48.78 1 5 0 72 331.784 2 ↓

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

No pre-computed analogs available. Try a structural similarity search.