UCSF

ZINC65497500

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 18 Yes

Popular Name: 5-[(3aR,4R)-4,5,6,7-tetrahydro-3aH-imidazo[4,5-c]pyridin-4-yl]-N,N-dimethyl-pyridin-2-amine 5-[(3aR,4R)-4,5,6,7-tetrahydro-3…

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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) 0.99 5.06 -34.34 3 5 1 58 244.322 2 ↓
Hi High (pH 8-9.5) 0.99 4.57 -10.36 2 5 0 57 243.314 2 ↓
Mid Mid (pH 6-8) 0.99 4.87 -26.04 3 5 1 58 244.322 2 ↓
Mid Mid (pH 6-8) 0.99 5.4 -79.4 4 5 2 59 245.33 2 ↓

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Rings

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

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