UCSF

ZINC31898507

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 31 No

Popular Name: 2-[5,6-dimethyl-4-oxo-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidin-3-yl]-N-(4-nitrophenyl)acetami 2-[5,6-dimethyl-4-oxo-2-(pyrroli…

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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) 2.48 11.84 -63.86 2 9 1 114 442.521 6 ↓
Hi High (pH 8-9.5) 2.48 9.4 -23.67 1 9 0 113 441.513 6 ↓

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