UCSF

ZINC13122807

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) 4.03 6.34 -27.08 1 4 0 63 317.288 5
Mid Mid (pH 6-8) 4.03 5.31 -53.09 0 4 -1 62 316.28 5

Vendor Notes

Note Type Comments Provided By
melting_point 1.180000000000000e+002 - 1.210000000000000e+002 KeyOrganics
melting_point 118 - 121 KeyOrganics
MP 118-121° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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