UCSF

ZINC36154333

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 22 Yes

Popular Name: 2-[(cyclopropylamino)methyl]-5-(2-fluorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-[(cyclopropylamino)methyl]-5-(…

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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) 2.61 7.39 -52.89 3 4 1 62 316.381 4 ↓
Hi High (pH 8-9.5) 3.07 5 -46.46 2 4 0 65 315.373 4 ↓
Hi High (pH 8-9.5) 2.61 6.1 -13.46 2 4 0 58 315.373 4 ↓

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

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