UCSF

ZINC71524201

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 27 Yes

Popular Name: (4R)-4-(3-pyrazol-1-ylphenyl)-5-(3-pyridylmethyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine (4R)-4-(3-pyrazol-1-ylphenyl)-5-…

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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) 2.10 9.51 -38.1 2 6 1 64 357.441 4 ↓
Mid Mid (pH 6-8) 2.10 9.04 -14.75 1 6 0 63 356.433 4 ↓
Mid Mid (pH 6-8) 2.10 10.83 -43.96 2 6 1 64 357.441 4 ↓
Lo Low (pH 4.5-6) 2.10 11.29 -107.2 3 6 2 65 358.449 4 ↓

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

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