UCSF

ZINC13256266

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 29 Yes

Popular Name: 2-[(1-isobutylbenzimidazol-2-yl)sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidine-5-carboxylic 2-[(1-isobutylbenzimidazol-2-yl)…

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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) 3.12 9.86 -62.62 1 8 -1 117 411.463 6 ↓
Mid Mid (pH 6-8) 3.58 7.4 -130.88 0 8 -2 120 410.455 6 ↓
Lo Low (pH 4.5-6) 3.12 10.1 -79.21 2 8 0 118 412.471 6 ↓

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

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