UCSF

ZINC33927158

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 26 No

Popular Name: (5Z)-5-[(3-bromo-4-hydroxy-phenyl)methylene]-1-(2,5-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6 (5Z)-5-[(3-bromo-4-hydroxy-pheny…

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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) 4.20 6.59 -44.37 1 5 -1 78 430.303 2 ↓
Hi High (pH 8-9.5) 4.20 7.37 -91.3 0 5 -2 81 429.295 2 ↓
Lo Low (pH 4.5-6) 3.74 8.56 -10.96 2 5 0 75 431.311 2 ↓

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