UCSF

ZINC01494953

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) 0.68 -0.31 -11.39 1 3 0 50 123.111 1
Hi High (pH 8-9.5) 0.68 0.46 -37.71 0 3 -1 53 122.103 1

Vendor Notes

Note Type Comments Provided By
BP 64°/5 Torr Matrix Scientific
MP 80-82° Oakwood Chemical
MP 80-82° (sub.) Fluorochem
MP 80-82°(sub) Matrix Scientific
MP 80-82°(sub.) Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
BP 96-100°/30mm Oakwood Chemical
Purity 98% 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.