[2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Formula:C17H16N2O5S Mutagenic:high Tumorigenic:none Reproductive Effective:none [2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C17H16N2O5S
Smiles	NC(c1c(NC(COC(/C=C/c2ccco2)=O)=O)sc2c1CCC2)=O
InChI	InChI=1S/C17H16N2O5S/c18-16(22)15-11-4-1-5-12(11)25-17(15)19-13(20)9-24-14(21)7-6-10-3-2-8-23-10/h2-3,6-8H,1,4-5,9H2,(H2,18,22)(H,19,20)
InChIK	DFJGXMROWUXZGE-UHFFFAOYSA-N
TotalMolweight	360.389
Molweight	360.389
MonoisotopicMass	360.077993
CLogP	1.8412
CLogS	-4.154
H Acceptors	7
H Donors	2
TotalSurfaceArea	269.92
Relative PSA	0.40871
PolarSurfaceArea	139.87
Druglikeness	0.31445
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	5
Amides	2
StereoCon

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1 - [2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate | 2 - [2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

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