UCSF

ZINC00107739

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) 2.19 4.23 -3.28 2 3 0 38 246.232 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 125-128? Alfa-Aesar
Melting_Point 125-128° Alfa-Aesar
MP 127-128° Matrix Scientific
MP 133 - 135 Enamine Building Blocks
MP 133...135 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific
Warnings Toxic Matrix Scientific

Activity (Go SEA)

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