UCSF

ZINC71514128

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 20 No

Popular Name: 6-ethyl-3-(1-methyl-4-piperidyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one 6-ethyl-3-(1-methyl-4-piperidyl)…

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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) 2.01 9.04 -36.12 2 4 1 42 310.468 2 ↓
Hi High (pH 8-9.5) 2.47 7.96 -43.05 1 4 0 45 309.46 2 ↓

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

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