UCSF

ZINC34138445

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 11th, 2009 29 No

Popular Name: (5Z)-1-(4-bromo-3-methyl-phenyl)-5-[(4-hydroxy-3,5-dimethoxy-phenyl)methylene]hexahydropyrimidine-2, (5Z)-1-(4-bromo-3-methyl-phenyl)…

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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) 2.85 2.58 -45.32 1 8 -1 114 460.26 4 ↓
Hi High (pH 8-9.5) 2.85 3.62 -102.1 0 8 -2 117 459.252 4 ↓
Lo Low (pH 4.5-6) 2.39 5.27 -13.75 2 8 0 111 461.268 4 ↓

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