UCSF

ZINC09280123

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 15 Yes

Popular Name: 1-Propyl-1,3-benzodiazole-5-carboxylic acid 1-Propyl-1,3-benzodiazole-5-carb…

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CAS Numbers: 369630-71-7 , N/A , [369630-71-7]

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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) 2.26 0.83 -57 0 4 -1 58 203.221 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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