UCSF

ZINC39272706

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 15 Yes

Popular Name: (3aS,4S)-4-(4-pyridyl)-4,5,6,7-tetrahydro-3aH-imidazo[4,5-c]pyridine (3aS,4S)-4-(4-pyridyl)-4,5,6,7-t…

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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) 0.16 1.17 -8.7 1 4 0 50 200.245 1 ↓
Mid Mid (pH 6-8) 0.16 2.41 -52.83 2 4 1 54 201.253 1 ↓

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

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