(E)-3-(1,3-benzodioxol-5-yl)-N-[6-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide

Formula:C26H28N2O6 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-3-(1,3-benzodioxol-5-yl)-N-[6-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(1,3-benzodioxol-5-yl)-N-[6-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide
MolecularFormula	C26H28N2O6
Smiles	O=C(/C=C/c(cc1)cc2c1OCO2)NCCCCCCNC(/C=C/c(cc1)cc2c1OCO2)=O
InChI	InChI=1S/C26H28N2O6/c29-25(11-7-19-5-9-21-23(15-19)33-17-31-21)27-13-3-1-2-4-14-28-26(30)12-8-20-6-10-22-24(16-20)34-18-32-22/h5-12,15-16H,1-4,13-14,17-18H2,(H,27,29)(H,28,30)
InChIK	LTTPDBMOQWAKPP-UHFFFAOYSA-N
TotalMolweight	464.516
Molweight	464.516
MonoisotopicMass	464.194738
CLogP	4.731
CLogS	-6.1
H Acceptors	8
H Donors	2
TotalSurfaceArea	367.52
Relative PSA	0.24216
PolarSurfaceArea	95.12
Druglikeness	-6.2325
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.70588
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	11
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	12
Symmetricatoms	17
Amides	2
StereoCon

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1 - (E)-3-(1,3-benzodioxol-5-yl)-N-[6-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide | 2 - (E)-3-(1,3-benzodioxol-5-yl)-N-[6-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide

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