UCSF

ZINC53649974

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 21 Yes

Popular Name: N-[[(2S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]methyl]-2-methyl-propan-1-amine N-[[(2S)-1-(imidazo[1,2-a]pyridi…

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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) 2.29 9.31 -87.49 3 4 2 38 288.439 6 ↓
Mid Mid (pH 6-8) 2.29 8.58 -34.73 2 4 1 37 287.431 6 ↓

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Rings

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

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