UCSF

ZINC62936163

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2011 19 Yes

Popular Name: (3R)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methyl-pyrrolidine-3-carboxylic (3R)-1-(imidazo[1,2-a]pyridin-2-…

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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) 1.34 9.62 -94.11 2 5 1 63 260.317 3 ↓
Hi High (pH 8-9.5) 1.34 6.63 -58.55 0 5 -1 61 258.301 3 ↓
Mid Mid (pH 6-8) 1.34 9.09 -51.37 1 5 0 62 259.309 3 ↓

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

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