N-benzyl-2-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetamide

Formula:C21H17N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-benzyl-2-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetamide is a drug-like molecule.

MolName	N-benzyl-2-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetamide
MolecularFormula	C21H17N3O3S
Smiles	O=C(Cn1c(cccc2)c2c(/C=C(/C(N2)=O)\SC2=O)c1)NCc1ccccc1
InChI	InChI=1S/C21H17N3O3S/c25-19(22-11-14-6-2-1-3-7-14)13-24-12-15(16-8-4-5-9-17(16)24)10-18-20(26)23-21(27)28-18/h1-10,12H,11,13H2,(H,22,25)(H,23,26,27)
InChIK	WQSPSQQFNLEQSR-UHFFFAOYSA-N
TotalMolweight	391.45
Molweight	391.45
MonoisotopicMass	391.099062
CLogP	2.0131
CLogS	-4.132
H Acceptors	6
H Donors	2
TotalSurfaceArea	289.21
Relative PSA	0.29874
PolarSurfaceArea	105.5
Druglikeness	5.1686
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	3
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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