N-[(E)-3-[4-[[(E)-2-benzamido-3-pyridin-3-ylprop-2-enoyl]amino]butylamino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide

Formula:C34H32N6O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3-[4-[[(E)-2-benzamido-3-pyridin-3-ylprop-2-enoyl]amino]butylamino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(E)-3-[4-[[(E)-2-benzamido-3-pyridin-3-ylprop-2-enoyl]amino]butylamino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide
MolecularFormula	C34H32N6O4
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\c1cnccc1)NCCCCNC(/C(/NC(c1ccccc1)=O)=C\c1cnccc1)=O
InChI	InChI=1S/C34H32N6O4/c41-31(27-13-3-1-4-14-27)39-29(21-25-11-9-17-35-23-25)33(43)37-19-7-8-20-38-34(44)30(22-26-12-10-18-36-24-26)40-32(42)28-15-5-2-6-16-28/h1-6,9-18,21-24H,7-8,19-20H2,(H,37,43)(H,38,44)(H,39,41)(H,40,42)
InChIK	HAUUXSGNWAWFLS-UHFFFAOYSA-N
TotalMolweight	588.666
Molweight	588.666
MonoisotopicMass	588.248504
CLogP	4.1726
CLogS	-5.298
H Acceptors	10
H Donors	4
TotalSurfaceArea	471.36
Relative PSA	0.25446
PolarSurfaceArea	142.18
Druglikeness	1.2198
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	44
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	13
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	4
Symmetricatoms	24
Amides	4
Aromatic Nitrogens	2
StereoCon

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1 - N-[(E)-3-[4-[[(E)-2-benzamido-3-pyridin-3-ylprop-2-enoyl]amino]butylamino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide | 2 - N-[(E)-3-[4-[[(E)-2-benzamido-3-pyridin-3-ylprop-2-enoyl]amino]butylamino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide

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