UCSF

ZINC39273057

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 34 No

Popular Name: 2-[[(5S)-5-cyano-4-oxo-6-phenyl-5H-pyrimidin-2-yl]sulfanyl]-N-[(4S,5S)-1,5-dimethyl-3-oxo-2-phenyl-p 2-[[(5S)-5-cyano-4-oxo-6-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) 3.30 5.61 -54.16 1 9 -1 125 473.538 6 ↓
Mid Mid (pH 6-8) 2.85 7.54 -25.36 2 9 0 122 474.546 6 ↓

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

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