UCSF

ZINC70115805

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2011 21 Yes

Popular Name: 2-[[(1S,2R,4R)-2,4-dimethylcyclohexyl]amino]imidazo[1,2-a]pyridine-3-carboxylic 2-[[(1S,2R,4R)-2,4-dimethylcyclo…

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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) 3.25 10.08 -60.93 3 5 1 75 288.371 3 ↓
Hi High (pH 8-9.5) 3.25 9.1 -62.04 1 5 -1 69 286.355 3 ↓
Mid Mid (pH 6-8) 3.25 9.54 -49.54 2 5 0 71 287.363 3 ↓

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

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