UCSF

ZINC52566038

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2010 34 Yes

Popular Name: 3-[(1R)-1-[2-chloro-4-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]ethoxy]-5-imidazo[1,2-a]pyridin- 3-[(1R)-1-[2-chloro-4-[[(3R)-3-h…

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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) 3.65 9.19 -49.12 4 7 1 94 498.028 7 ↓
Hi High (pH 8-9.5) 3.65 6.86 -17.11 3 7 0 93 497.02 7 ↓
Mid Mid (pH 6-8) 3.65 9.68 -85.5 5 7 2 96 499.036 7 ↓

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