(E)-N-[4-nitro-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]phenyl]-3-thiophen-2-ylprop-2-enamide

Formula:C20H15N3O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[4-nitro-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]phenyl]-3-thiophen-2-ylprop-2-enamide is a drug-like molecule.

MolName	(E)-N-[4-nitro-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]phenyl]-3-thiophen-2-ylprop-2-enamide
MolecularFormula	C20H15N3O4S2
Smiles	[O-][N+](c(ccc(NC(/C=C/c1cccs1)=O)c1)c1NC(/C=C/c1cccs1)=O)=O
InChI	InChI=1S/C20H15N3O4S2/c24-19(9-6-15-3-1-11-28-15)21-14-5-8-18(23(26)27)17(13-14)22-20(25)10-7-16-4-2-12-29-16/h1-13H,(H,21,24)(H,22,25)
InChIK	SNFMGICNAGIXHF-UHFFFAOYSA-N
TotalMolweight	425.488
Molweight	425.488
MonoisotopicMass	425.050397
CLogP	3.4246
CLogS	-5.86
H Acceptors	7
H Donors	2
TotalSurfaceArea	319.75
Relative PSA	0.37573
PolarSurfaceArea	160.5
Druglikeness	-3.4046
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
Amides	2
AcidicOxygens	1
StereoCon

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1 - (E)-N-[4-nitro-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]phenyl]-3-thiophen-2-ylprop-2-enamide | 2 - (E)-N-[4-nitro-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]phenyl]-3-thiophen-2-ylprop-2-enamide

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