UCSF

ZINC70306182

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2011 19 Yes

Popular Name: (1R)-1-cyclopentyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine (1R)-1-cyclopentyl-N-[(2-methyli…

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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) 3.43 9.29 -46.08 2 3 1 34 258.389 4 ↓
Hi High (pH 8-9.5) 3.43 8.06 -8.17 1 3 0 29 257.381 4 ↓
Lo Low (pH 4.5-6) 3.43 9.73 -96.6 3 3 2 35 259.397 4 ↓

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

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