UCSF

ZINC49235769

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2010 14 Yes

Popular Name: 1-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]pyrrolidin-2-imine 1-[(1S)-2-imidazol-1-yl-1-methyl…

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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) 0.44 7.27 -86.39 3 4 2 48 194.282 3 ↓
Mid Mid (pH 6-8) 0.44 6.76 -32.2 2 4 1 47 193.274 3 ↓

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

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