UCSF

ZINC13140223

Substance Information

In ZINC since Heavy atoms Benign functionality
May 30th, 2008 20 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) -1.67 -3.81 -25.56 6 9 0 142 299.312 2

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0038541A1; EP0215942A1; EP0215942B1; EP0216860A1; EP0216860B1; EP0233493A2; EP0238672A1; EP0348446A1; EP0348446B1; EP0353268A1; EP0353268B1; EP0404925B1; EP0414730A1; EP0414730B1; EP0506830A1; EP0506845B1; EP0570519A1; EP0570519B1; EP0586523A1; EP059466 IBM Patent Data

Activity (Go SEA)

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