UCSF

ZINC16898237

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 35 Yes

Popular Name: (2R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[4-oxo-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl] (2R)-N-[2-(3,4-dimethoxyphenyl)e…

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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) 5.31 10.18 -22.57 2 7 0 93 509.653 9 ↓
Mid Mid (pH 6-8) 5.31 10.43 -19.79 2 7 0 93 509.653 9 ↓
Mid Mid (pH 6-8) 5.77 8.93 -52.05 1 7 -1 96 508.645 9 ↓

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