UCSF

ZINC00266870

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 22 Yes

Popular Name: 1-(4-Isopropylphenyl)-2-methyl-1H-benzimidazole-5-carboxylic acid 1-(4-Isopropylphenyl)-2-methyl-1…

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CAS Numbers: , 442531-53-5

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) 4.26 11.44 -53.73 0 4 -1 58 293.346 3 ↓
Mid Mid (pH 6-8) 4.26 11.88 -48.83 1 4 0 59 294.354 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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