UCSF

ZINC62038958

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 27 No

Popular Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-hydroxy-5-nitro-phenyl)acetamid 2-[(5,6-dimethyl-4-oxo-3H-thieno…

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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) 3.29 4.03 -22.5 3 9 0 141 406.445 5 ↓
Hi High (pH 8-9.5) 3.75 3.48 -90.42 1 9 -2 147 404.429 5 ↓
Mid Mid (pH 6-8) 3.29 4.8 -43.48 2 9 -1 144 405.437 5 ↓

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

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