UCSF

ZINC39294939

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 29 Yes

Popular Name: (2R,3S,4R)-3-[(E,3R)-3-(1-butylcyclobutyl)-3-hydroxy-prop-1-enyl]-2-[(E,7S)-7,8-dihydroxyoct-2-enyl] (2R,3S,4R)-3-[(E,3R)-3-(1-butylc…

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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) 2.58 3.91 -10.15 4 5 0 98 408.579 13 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4288629; US4288630; US4288632; US4288633; US4291174; US4291175; US4310700 IBM Patent Data

Activity (Go SEA)

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