UCSF

ZINC13256172

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 34 Yes

Popular Name: 4-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-3-methyl-6-oxo-7H-thieno[5,4-b]pyridine-2-ca 4-[[1-(4-ethoxyphenyl)benzimidaz…

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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) 5.57 12.48 -50.74 1 7 -1 100 490.586 7 ↓
Lo Low (pH 4.5-6) 5.57 12.95 -54.41 2 7 0 101 491.594 7 ↓

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

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