UCSF

ZINC69661157

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2011 21 Yes

Popular Name: 1-methyl-5-(1-naphthylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine 1-methyl-5-(1-naphthylmethyl)-6,…

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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) 2.03 9.97 -32.07 1 3 1 22 278.379 2 ↓
Hi High (pH 8-9.5) 2.03 9.51 -11 0 3 0 21 277.371 2 ↓
Mid Mid (pH 6-8) 2.03 12.22 -102.07 2 3 2 24 279.387 2 ↓
Lo Low (pH 4.5-6) 2.03 11.75 -43.78 1 3 1 22 278.379 2 ↓

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Rings

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

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