UCSF

ZINC04546644

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2005 29 Yes

Popular Name: 5,6-trans-25-Hydroxyvitamin D3 5,6-trans-25-Hydroxyvitamin D3

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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) 6.47 10.36 -3.85 2 2 0 40 400.647 6 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5922571; US6015678; WO1998039444A1; WO2000038650A1 IBM Patent Data

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