UCSF

ZINC12341384

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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) 1.73 2.71 -8.95 1 2 0 33 159.188 0
Lo Low (pH 4.5-6) 1.73 3.06 -27.38 2 2 1 34 160.196 0

Vendor Notes

Note Type Comments Provided By
BP 145 / 15 TCI
BP [°C] 267 Acros Organics
Boiling_Point 267? Alfa-Aesar
Boiling_Point 267° Alfa-Aesar
Mp [°C] 70 - 74 Acros Organics
Melting_Point 70-74? Alfa-Aesar
Melting_Point 70-74° Alfa-Aesar
MP 72 - 73 Enamine Building Blocks
MP 72...73 Enamine Building Blocks
MP 73 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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