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MYCALENITRILE 7
FEATURES
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NAMES
  • Mycalenitrile 7
SMILES
N#CCCCC/C=C\C/C=C\CCCCCCCCCCCCc1ccc(C=O)[nH]1
InChI
InChI=1S/C27H42N2O/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/h4,6,10,12,22-23,25,29H,1-3,5,7-9,11,13-21H2/b6-4-,12-10-
MOLECULAR FORMULA
C27H42N2O
CROSS REFERENCES
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MYCALENITRILE 7

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 410.33
AlogP 8.25
HBond donors 1
HBond acceptors 3
Atoms 72
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 7.