N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-(1H-indol-3-yl)acetamide

Formula:C22H19N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-(1H-indol-3-yl)acetamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-(1H-indol-3-yl)acetamide
MolecularFormula	C22H19N3O3S
Smiles	O=C(Cc1c[nH]c2c1cccc2)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C22H19N3O3S/c26-20(13-16-14-24-18-9-5-4-8-17(16)18)23-10-11-25-21(27)19(29-22(25)28)12-15-6-2-1-3-7-15/h1-9,12,14,24H,10-11,13H2,(H,23,26)
InChIK	MONOTIAWKKFUKH-UHFFFAOYSA-N
TotalMolweight	405.477
Molweight	405.477
MonoisotopicMass	405.114712
CLogP	2.7136
CLogS	-4.514
H Acceptors	6
H Donors	2
TotalSurfaceArea	302.18
Relative PSA	0.28331
PolarSurfaceArea	107.57
Druglikeness	6.17
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.62069
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	4
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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