UCSF

ZINC12350055

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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) -0.63 5.87 -67.81 1 4 -1 73 206.152 1
Mid Mid (pH 6-8) -0.63 3.87 -18.78 2 4 0 70 207.16 1
Lo Low (pH 4.5-6) 0.67 4.62 -124.07 0 4 -2 76 205.144 1
Lo Low (pH 4.5-6) -0.63 5.05 -30.03 2 4 0 76 207.16 1

Vendor Notes

Note Type Comments Provided By
melting_point 298 - 300 KeyOrganics
MP 298-300° Matrix Scientific
BP 362° Matrix Scientific
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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