UCSF

ZINC71514598

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 26 No

Popular Name: 2-[(6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(p-tolylsulfonyl)acetamide 2-[(6-methyl-4-oxo-3H-thieno[2,3…

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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) 3.09 2.29 -61.39 1 7 -1 115 408.506 5 ↓
Mid Mid (pH 6-8) 3.55 0.85 -115.38 0 7 -2 118 407.498 5 ↓
Lo Low (pH 4.5-6) 2.90 4.04 -22.54 2 7 0 109 409.514 5 ↓

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

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