UCSF

ZINC63746734

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 28 No

Popular Name: (2R)-2-[(4-amino-6-oxo-5H-pyrimidin-2-yl)sulfanyl]-N-(2-ethoxyphenyl)-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) 2.31 6.53 -16.81 3 7 0 106 396.472 7 ↓
Hi High (pH 8-9.5) 2.31 6.59 -35.73 2 7 -1 104 395.464 7 ↓
Lo Low (pH 4.5-6) 2.31 6.95 -45.24 4 7 1 108 397.48 7 ↓

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

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