UCSF

ZINC01529518

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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) -0.61 -3.13 -9.61 2 4 0 58 114.104 0

Vendor Notes

Note Type Comments Provided By
MP 298 - 300 Enamine Building Blocks
MP 298...300 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Mp [°C] >300 Acros Organics
UniProt Database Links ALBA_STRNR; CDLS_BACLD; CDLS_BACSU; CDLS_CORJK; CDLS_PHOLL; CDLS_STAHJ; CDTS_MYCTU; CLPS_STRNR; THCL1_AMISM ChEBI
Melting_Point ca 300? dec. Alfa-Aesar
Melting_Point ca 300° dec. Alfa-Aesar
Patent Database Links EP1619193; US2002019013; US2006079534; WO2006067462 ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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

No pre-computed analogs available. Try a structural similarity search.