UCSF

ZINC49543749

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 26 Yes

Popular Name: 3-[[(4R)-2-oxo-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazole-4-carbonyl]amino]benzoic 3-[[(4R)-2-oxo-3,4-dihydro-1H-py…

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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) 1.99 5.18 -70.37 2 8 -1 120 349.326 3 ↓
Ref Reference (pH 7) 1.99 5.92 -116.32 1 8 -2 122 348.318 3 ↓
Mid Mid (pH 6-8) 1.98 7.26 -69.59 2 8 -1 119 349.326 3 ↓
Lo Low (pH 4.5-6) 1.98 8.99 -77.33 3 8 0 121 350.334 3 ↓
Lo Low (pH 4.5-6) 1.99 5.65 -69.76 3 8 0 121 350.334 3 ↓

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

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