UCSF

ZINC58343359

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 25 Yes

Popular Name: (2S)-2-[[4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methylamino]-N-methyl-propanamide (2S)-2-[[4-(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) 2.19 6.07 -15.97 2 6 0 68 338.411 7 ↓
Mid Mid (pH 6-8) 2.19 6.51 -33.61 3 6 1 69 339.419 7 ↓
Mid Mid (pH 6-8) 2.19 7.32 -49.92 3 6 1 72 339.419 7 ↓
Lo Low (pH 4.5-6) 2.19 7.77 -79.49 4 6 2 73 340.427 7 ↓

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Rings

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

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