UCSF

ZINC19772709

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2008 14 Yes

Popular Name: 2-ethyl-1H-benzimidazole-5-carboxylic acid 2-ethyl-1H-benzimidazole-5-carbo…

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CAS Numbers: 26663-77-4 , 891454-18-5 , N/A

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) 1.98 5.19 -49.53 1 4 -1 69 189.194 2 ↓
Lo Low (pH 4.5-6) 1.98 5.59 -54.43 2 4 0 70 190.202 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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