UCSF

ZINC03875421

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 21 Yes

Popular Name: 2C17H19NO3.H2O4S; Astramorph; Avinza; DepoDur; Duramorph; EINECS 200-582-8; Infumorph; Kadian; Kapanol; LS-1542; MORPHINE SULFATE (MORPHINE (57-27-2)); MS Contin; MST; MST-1 Continus; Morphinan-3,6-alpha-diol, 7,8-didehydro-4, 5-alpha-epoxy-17-methyl-, su 2C17H19NO3.H2O4S; Astramorph; Av…

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Download: MOL2 SDF SMILES Flexibase

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) 1.10 1.85 -53.69 3 4 1 54 286.351 0 ↓
Hi High (pH 8-9.5) 1.10 -0.04 -10.53 2 4 0 53 285.343 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0799231A1; EP0799231B1; EP0815088A1; EP0815107A1; EP0835253A1; EP0861251A1; EP0866790A1; EP0880528A1; EP0880529A1; EP0906315A1; EP0912579A1; EP0929554A1; EP0977758A1; EP0989987A1; EP0991622A1; EP0994867A1; EP1019410A1; EP1028957A1; EP1059923A1; US572869 IBM Patent Data

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

No pre-computed analogs available. Try a structural similarity search.