UCSF

ZINC13426458

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 10 Yes

Popular Name: 2-(1H-imidazol-1-yl)propanoic acid 2-(1H-imidazol-1-yl)propanoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 753489-91-7 , 90269-13-9

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) -0.40 4.05 -43.1 0 4 -1 58 139.134 2 ↓
Mid Mid (pH 6-8) -0.40 4.55 -39.04 1 4 0 59 140.142 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 119 - 121 Enamine Building Blocks
MP 119...121 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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