UCSF

ZINC63100827

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2011 17 No

Popular Name: 2-sulfanyl-3-(3,3,3-trifluoropropyl)thieno[3,2-d]pyrimidin-4-one 2-sulfanyl-3-(3,3,3-trifluoropro…

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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) 2.45 5.01 -37.64 0 3 -1 41 279.288 3 ↓
Mid Mid (pH 6-8) 2.00 6.37 -10.95 1 3 0 38 280.296 3 ↓

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

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