UCSF

ZINC02382100

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 13 Yes

Popular Name: 2-Chloro-3,6-difluorophenylacetic acid 2-Chloro-3,6-difluorophenylaceti…

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CAS Number: 261762-52-1

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) 2.22 2.33 -47.45 0 2 -1 40 205.567 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 135-139? Alfa-Aesar
Melting_Point 135-139° Alfa-Aesar
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.