UCSF

ZINC71566642

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 31 No

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

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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) 5.28 10.01 -23.8 2 8 0 121 452.517 6 ↓
Hi High (pH 8-9.5) 5.74 8.56 -54.7 1 8 -1 124 451.509 6 ↓

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

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