UCSF

ZINC37293600

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2009 20 Yes

Popular Name: (1R)-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (1R)-N-[(2-methylimidazo[1,2-a]p…

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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) 0.91 7.8 -34.75 2 6 1 61 271.348 4 ↓
Mid Mid (pH 6-8) 0.91 8.63 -55.69 2 6 1 65 271.348 4 ↓
Mid Mid (pH 6-8) 0.91 7.35 -19.49 1 6 0 60 270.34 4 ↓
Mid Mid (pH 6-8) 0.91 9.07 -103.5 3 6 2 66 272.356 4 ↓

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Rings

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

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