UCSF

ZINC13282091

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 25 Yes

Popular Name: (4R)-4-(2-chloro-3-quinolyl)-3,4-dihydro-[1,3,5]triazino[5,4-a]benzimidazol-2-amine (4R)-4-(2-chloro-3-quinolyl)-3,4…

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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) 3.38 10.34 -15.37 3 6 0 81 348.797 1 ↓
Mid Mid (pH 6-8) 3.38 10.83 -35.83 4 6 1 83 349.805 1 ↓

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

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