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MYCALENITRILE 11
FEATURES
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NAMES
  • Mycalenitrile 11
SMILES
N#CCCCCCCCCCCCCC/C=C\CCCCCCc1ccc(C=O)[nH]1
InChI
InChI=1S/C27H44N2O/c28-24-20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-21-26-22-23-27(25-30)29-26/h7,9,22-23,25,29H,1-6,8,10-21H2/b9-7-
MOLECULAR FORMULA
C27H44N2O
CROSS REFERENCES
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MYCALENITRILE 11

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 412.35
AlogP 8.47
HBond donors 1
HBond acceptors 3
Atoms 74
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by MYCALENITRILE 11.