UCSF

ZINC13408313

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 23 No

Popular Name: (2E,5S,8R,9R,10S,13S,14S,17S)-17-hydroxy-2-(hydroxymethylene)-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15 (2E,5S,8R,9R,10S,13S,14S,17S)-17…

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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) 2.64 5.74 -45.89 1 3 -1 60 317.449 0 ↓
Mid Mid (pH 6-8) 3.35 5.79 -9.12 1 3 0 54 318.457 1 ↓
Mid Mid (pH 6-8) 3.93 5.28 -9.56 2 3 0 58 318.457 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0583579A2; EP0583579B1; EP0583606A2; EP0583606A3; US5444055; US5538960 IBM Patent Data

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