(E)-3-(furan-2-yl)-N-[4-[[4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]cyclohexyl]methyl]cyclohexyl]prop-2-enamide

Formula:C27H34N2O4 Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-3-(furan-2-yl)-N-[4-[[4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]cyclohexyl]methyl]cyclohexyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(furan-2-yl)-N-[4-[[4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]cyclohexyl]methyl]cyclohexyl]prop-2-enamide
MolecularFormula	C27H34N2O4
Smiles	O=C(/C=C/c1ccco1)NC1CCC(CC(CC2)CCC2NC(/C=C/c2ccco2)=O)CC1
InChI	InChI=1S/C27H34N2O4/c30-26(15-13-24-3-1-17-32-24)28-22-9-5-20(6-10-22)19-21-7-11-23(12-8-21)29-27(31)16-14-25-4-2-18-33-25/h1-4,13-18,20-23H,5-12,19H2,(H,28,30)(H,29,31)
InChIK	OOWZKEFIGVVYAU-UHFFFAOYSA-N
TotalMolweight	450.577
Molweight	450.577
MonoisotopicMass	450.251858
CLogP	4.3598
CLogS	-6.1
H Acceptors	6
H Donors	2
TotalSurfaceArea	370.66
Relative PSA	0.20833
PolarSurfaceArea	84.48
Druglikeness	-0.028341
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.69697
Fragments	1
Non HAtoms	33
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	13
Symmetricatoms	18
Amides	2
StereoCon

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1 - (E)-3-(furan-2-yl)-N-[4-[[4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]cyclohexyl]methyl]cyclohexyl]prop-2-enamide | 2 - (E)-3-(furan-2-yl)-N-[4-[[4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]cyclohexyl]methyl]cyclohexyl]prop-2-enamide

Request More Details | (E)-3-(furan-2-yl)-N-[4-[[4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]cyclohexyl]methyl]cyclohexyl]prop-2-enamide

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