UCSF

ZINC04027336

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 15 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) 4.54 3.17 -4.66 0 1 0 17 206.329 3

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0371264A2; EP0371264B1; EP0628544A1; EP0628544B1; EP0905115A1; EP0971021A1; EP0971024A1; EP0971025A1; EP0971026A1; EP0971027A1; EP1019444A1; EP1034202A1; US3953524; US3989758; US3998856; US4000131; US4044028; US4916250; US5061819; US5077417; US5155238 IBM Patent Data

Activity (Go SEA)

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