2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate

Formula:C16H10NO4S2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate is a drug-like molecule.

MolName	2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate
MolecularFormula	C16H10NO4S2
Smiles	[O-]C(c1c(NC(/C=C/c2ccco2)=O)scc1-c1cccs1)=O
InChI	InChI=1S/C16H11NO4S2/c18-13(6-5-10-3-1-7-21-10)17-15-14(16(19)20)11(9-23-15)12-4-2-8-22-12/h1-9H,(H,17,18)(H,19,20)/p-1
InChIK	FBZPAKPKWRPKCY-UHFFFAOYSA-M
TotalMolweight	344.39
Molweight	344.39
MonoisotopicMass	344.005124
CLogP	1.3908
CLogS	-5.25
H Acceptors	5
H Donors	1
TotalSurfaceArea	255.34
Relative PSA	0.41768
PolarSurfaceArea	138.85
Druglikeness	2.9038
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

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1 - 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate | 2 - 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate

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