UCSF

ZINC00098250

Annotations

Vendors

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) 1.70 7.14 -45.83 0 3 -1 57 191.206 4
Lo Low (pH 4.5-6) 1.70 5.16 -7.53 1 3 0 54 192.214 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 124-128? Alfa-Aesar
Melting_Point 124-128° Alfa-Aesar
MP 126 - 128 Enamine Building Blocks
MP 127 - 130 Enamine Building Blocks
MP 128 TCI
purity 9.500000000000000e+001 Enamine Building Blocks
Purity 98% APIChem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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