UCSF

ZINC37328664

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 18 No

Popular Name: 2-[(4-oxo-1-piperidyl)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(4-oxo-1-piperidyl)methyl]-3H…

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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) 0.68 2.65 -51.94 1 5 0 70 263.322 2 ↓
Mid Mid (pH 6-8) 0.23 5.44 -60.51 2 5 1 67 264.33 2 ↓
Mid Mid (pH 6-8) 0.23 3.26 -15.46 1 5 0 66 263.322 2 ↓

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

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