UCSF

ZINC63749927

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 27 No

Popular Name: (2R)-2-[(4-amino-6-oxo-5H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)-2-phenyl-acetamide (2R)-2-[(4-amino-6-oxo-5H-pyrimi…

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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) 2.75 7.5 -16.94 3 6 0 97 380.473 5 ↓
Hi High (pH 8-9.5) 2.75 7.56 -35.14 2 6 -1 94 379.465 5 ↓
Lo Low (pH 4.5-6) 2.75 7.92 -46.16 4 6 1 99 381.481 5 ↓

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

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