UCSF

ZINC13282307

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 15 Yes

Popular Name: 2-Amino-3-methyl-3H-imidazo[4,5-f]quinoline 2-Amino-3-methyl-3H-imidazo[4,5-…

Find On: PubMed — Wikipedia — Google

CAS Number: 76180-96-6

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) 1.56 5.76 -11.71 2 4 0 57 198.229 0 ↓
Mid Mid (pH 6-8) 1.56 6.19 -33 3 4 1 58 199.237 0 ↓
Lo Low (pH 4.5-6) 1.56 6.48 -81.8 4 4 2 59 200.245 0 ↓
Lo Low (pH 4.5-6) 1.56 6.04 -34.13 3 4 1 58 199.237 0 ↓

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Rings

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

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