UCSF

ZINC38584728

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 15 Yes

Popular Name: 3H-Imidazo[4,5-f]quinoline, 3,7-dimethyl- (9CI) 3H-Imidazo[4,5-f]quinoline, 3,7-…

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CAS Number: 156139-13-8

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) 1.81 6.88 -11.72 0 3 0 31 197.241 0 ↓
Lo Low (pH 4.5-6) 1.81 7.35 -37.68 1 3 1 32 198.249 0 ↓

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

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