UCSF

ZINC11535934

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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) 0.80 4.91 -134.99 0 4 -2 80 180.159 2

Vendor Notes

Note Type Comments Provided By
MP 175 - 177 Enamine Building Blocks
mp 175 - 178 MolMall (formerly Molecular Diversity Preservation International)
MP 175...177 Enamine Building Blocks
Melting_Point 175? dec. Alfa-Aesar
Melting_Point 175° dec. Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Melting_Point >300? Alfa-Aesar
Melting_Point >300° Alfa-Aesar
PUBCHEM_PATENT_ID US4916231; US5002972 IBM Patent Data

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