UCSF

ZINC34926265

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 15 Yes

Popular Name: 3-(3-bromophenyl)-1H-pyrazole-4-carboxylic acid 3-(3-bromophenyl)-1H-pyrazole-4-…

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CAS Numbers: 879996-70-0 , [879996-70-0]

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) 2.28 5.64 -49.15 1 4 -1 69 266.074 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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