UCSF

ZINC00158004

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) -0.03 -1.76 -6.92 2 2 0 40 116.16 0

Vendor Notes

Note Type Comments Provided By
MP 100 - 100 Enamine Building Blocks
MP 100 - 102 Enamine Building Blocks
MP 101 TCI
MP 110 TCI
BP 132 / 24 TCI
MP 140 TCI
Boiling_Point 149-151?/20mm Alfa-Aesar
Boiling_Point 149-151°/20mm Alfa-Aesar
BP [°C] 150 (p=20 torr) Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
MP 98 - 100 Enamine Building Blocks
Mp [°C] 98 - 102 Acros Organics
Melting_Point 98-103? Alfa-Aesar
Melting_Point 98-103° Alfa-Aesar
MP 98...100 Enamine Building Blocks
MP 99 - 100 Enamine Building Blocks
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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

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