UCSF

ZINC02560143

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 Yes

Popular Name: 4-(Difluoromethoxy)phenylacetonitrile 4-(Difluoromethoxy)phenylacetoni…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 41429-16-7 , [41429-16-7]

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) 2.52 3.77 -10.97 0 2 0 33 183.157 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings TOXIC Matrix Scientific

Activity (Go SEA)

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