UCSF

ZINC13282168

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 29 No

Popular Name: 1-(4-chlorophenyl)-3-(1-ethylpyridin-1-ium-3-yl)benzo[f]quinoline 1-(4-chlorophenyl)-3-(1-ethylpyr…

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Download: MOL2 SDF SMILES Flexibase

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) 2.58 15.57 -33.84 0 2 1 17 395.913 3 ↓
Lo Low (pH 4.5-6) 2.58 15.78 -93.82 1 2 2 18 396.921 3 ↓

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

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