[2-oxo-2-(4-sulfamoylanilino)ethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Formula:C27H23N3O5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-oxo-2-(4-sulfamoylanilino)ethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate is not a drug-like molecule.

MolName	[2-oxo-2-(4-sulfamoylanilino)ethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C27H23N3O5S2
Smiles	NS(c(cc1)ccc1NC(COC(c1c(CCC/C2=C\c3cccs3)c2nc2ccccc12)=O)=O)(=O)=O
InChI	InChI=1S/C27H23N3O5S2/c28-37(33,34)20-12-10-18(11-13-20)29-24(31)16-35-27(32)25-21-7-1-2-9-23(21)30-26-17(5-3-8-22(25)26)15-19-6-4-14-36-19/h1-2,4,6-7,9-15H,3,5,8,16H2,(H,29,31)(H2,28,33,34)
InChIK	OTOWSKHTGDIPFU-UHFFFAOYSA-N
TotalMolweight	533.628
Molweight	533.628
MonoisotopicMass	533.107912
CLogP	4.0192
CLogS	-6.124
H Acceptors	8
H Donors	2
TotalSurfaceArea	382.39
Relative PSA	0.32093
PolarSurfaceArea	165.07
Druglikeness	3.7754
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51351
Fragments	1
Non HAtoms	37
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	6
Symmetricatoms	3
Amides	2
Aromatic Nitrogens	1
StereoCon

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