UCSF

ZINC00141114

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: 1-(1H-Benzimidazol-2-yl)ethanol 1-(1H-Benzimidazol-2-yl)ethanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16414-04-3 , 19018-24-7 , 192316-22-6 , 860187-76-4 , [19018-24-7]

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.10 1.39 -8.28 2 3 0 49 162.192 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 167 - 169 Enamine Building Blocks
MP 167...169 Enamine Building Blocks
MP 178 TCI
melting_point 180 - 182 KeyOrganics
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% )

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