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Danuphylline
FEATURES
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NAMES
  • Danuphylline
SMILES
COC(=O)N1c2c(ccc3c2OCO3)[C@]23CC(=O)C[C@@]4(CCCN(C=O)[C@@H]42)CCC13C(=O)OC
InChI
InChI=1S/C24H26N2O8/c1-31-20(29)24-8-7-22-6-3-9-25(12-27)19(22)23(24,11-14(28)10-22)15-4-5-16-18(34-13-33-16)17(15)26(24)21(30)32-2/h4-5,12,19H,3,6-11,13H2,1-2H3/t19-,22+,23+,24?/m0/s1
MOLECULAR FORMULA
C24H26N2O8
CROSS REFERENCES
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Danuphylline

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 470.17
AlogP 1.92
HBond donors 0
HBond acceptors 10
Atoms 60
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Danuphylline.