UCSF

ZINC05224925

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2006 46 No

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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) 1.33 4.4 -63.22 0 8 2 69 596.698 7

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0007058A1; EP0097904A1; EP0107594A1; EP0113103A1; EP0237738A2; EP0237738B1; EP0471740B1; EP0480676A2; EP0480676B1; EP0496409B1; EP0496410B1; EP0570414A1; EP0570414B1; EP0767909A1; EP1019531A1; US4172763; US4246341; US4273870; US4525453; US4557856; US458 IBM Patent Data

Activity (Go SEA)

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