(E)-3-thiophen-2-yl-N-[3-[4-[3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]propyl]piperazin-1-yl]propyl]prop-2-enamide

Formula:C24H32N4O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-thiophen-2-yl-N-[3-[4-[3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]propyl]piperazin-1-yl]propyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-thiophen-2-yl-N-[3-[4-[3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]propyl]piperazin-1-yl]propyl]prop-2-enamide
MolecularFormula	C24H32N4O2S2
Smiles	O=C(/C=C/c1cccs1)NCCCN1CCN(CCCNC(/C=C/c2cccs2)=O)CC1
InChI	InChI=1S/C24H32N4O2S2/c29-23(9-7-21-5-1-19-31-21)25-11-3-13-27-15-17-28(18-16-27)14-4-12-26-24(30)10-8-22-6-2-20-32-22/h1-2,5-10,19-20H,3-4,11-18H2,(H,25,29)(H,26,30)
InChIK	SCBNZBSRZWTORV-UHFFFAOYSA-N
TotalMolweight	472.676
Molweight	472.676
MonoisotopicMass	472.196666
CLogP	3.1108
CLogS	-3.15
H Acceptors	6
H Donors	2
TotalSurfaceArea	381.02
Relative PSA	0.25411
PolarSurfaceArea	121.16
Druglikeness	8.4978
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.75
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	12
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	12
Symmetricatoms	17
Amides	2
Amines	2
AlkylAmines	2
BasicNitrogens	2
StereoCon

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1 - (E)-3-thiophen-2-yl-N-[3-[4-[3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]propyl]piperazin-1-yl]propyl]prop-2-enamide | 2 - (E)-3-thiophen-2-yl-N-[3-[4-[3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]propyl]piperazin-1-yl]propyl]prop-2-enamide

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