UCSF

ZINC19993694

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 31 No

Popular Name: 2-[2-[(6-methyl-4-oxo-5-phenyl-3H-thieno[5,4-d]pyrimidin-2-yl)sulfanyl]ethyl]isoindoline-1,3-dione 2-[2-[(6-methyl-4-oxo-5-phenyl-3…

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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) 5.38 10.39 -23.34 1 6 0 85 447.541 5 ↓
Mid Mid (pH 6-8) 5.83 9.04 -57.63 0 6 -1 88 446.533 5 ↓

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

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