UCSF

ZINC01406632

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 18 Yes

Popular Name: 1-(3,4-dichlorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid 1-(3,4-dichlorophenyl)-3,5-dimet…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 477710-54-6 , [477710-54-6]

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) 3.10 8.16 -45.58 0 4 -1 58 284.122 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 238 - 240 KeyOrganics
MP 238-240° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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