UCSF

ZINC03883343

Draw Identity 99% 90% 80% 70%

Substance Information

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

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

Find On: PubMed — Wikipedia — Google

CAS Number: 303149-69-1

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) 2.66 6.48 -48.91 0 5 -1 67 265.676 3 ↓
Lo Low (pH 4.5-6) 2.66 6.59 -40.9 1 5 0 68 266.684 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 202-204° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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