UCSF

ZINC00157340

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) 1.45 2.22 -11.5 1 2 0 37 154.14 1

Vendor Notes

Note Type Comments Provided By
MP 112-121° Matrix Scientific
MP 117 - 119 Enamine Building Blocks
MP 117-119° Matrix Scientific
MP 117...119 Enamine Building Blocks
MP 117.5-119° Fluorochem
MP 118 - 119 Enamine Building Blocks
MP 118-119° Oakwood Chemical
MP 119 - 119 Enamine Building Blocks
MP 119 - 121 Enamine Building Blocks
Melting_Point 121-123? Alfa-Aesar
Melting_Point 121-123° Alfa-Aesar
MP 125 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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