UCSF

ZINC01532588

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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) -2.22 -7.8 -9.75 4 5 0 90 150.13 0

Vendor Notes

Note Type Comments Provided By
Mp [°C] 152 - 160 Acros Organics
Melting_Point 154-158? Alfa-Aesar
Melting_Point 154-158° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
UniProt Database Links AFTC_MYCTU; ALO_ASHGO; ALO_CANAL; ALO_CANGA; ALO_DEBHA; ALO_KLULA; ALO_NEUCR; ALO_SCHPO; ALO_YARLI; ALO_YEAST; API_HAEIN; ARA1_YEAST; ARA2_YEAST; ARADH_AZOBR; FCDH_PSESP; FUCI_ECOLI; FUCP_ECOLI; GULDH_MYCTU; GUTQ_ECO57; GUTQ_ECOL6; GUTQ_ECOLI; GUTQ_SALTI ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
PUBCHEM_PATENT_ID US5070089 IBM Patent Data

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