[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoate

Formula:C23H22N2O6S Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoate is a drug-like molecule.

MolName	[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoate
MolecularFormula	C23H22N2O6S
Smiles	O=C(COC(/C=C/c(cc1)ccc1S(N(CC1)c2c1cccc2)(=O)=O)=O)N(CCC1)C1=O
InChI	InChI=1S/C23H22N2O6S/c26-21-6-3-14-24(21)22(27)16-31-23(28)12-9-17-7-10-19(11-8-17)32(29,30)25-15-13-18-4-1-2-5-20(18)25/h1-2,4-5,7-12H,3,6,13-16H2
InChIK	JYRIUQDPRORKAD-UHFFFAOYSA-N
TotalMolweight	454.502
Molweight	454.502
MonoisotopicMass	454.119858
CLogP	2.0934
CLogS	-3.992
H Acceptors	8
TotalSurfaceArea	327.51
Relative PSA	0.25892
PolarSurfaceArea	109.44
Druglikeness	4.1372
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	3
Amides	2
StereoCon

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1 - [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoate | 2 - [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoate

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