(E)-N-[5,5-dioxo-7-[[(E)-3-phenylprop-2-enoyl]amino]dibenzothiophen-3-yl]-3-phenylprop-2-enamide

Formula:C30H22N2O4S Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-N-[5,5-dioxo-7-[[(E)-3-phenylprop-2-enoyl]amino]dibenzothiophen-3-yl]-3-phenylprop-2-enamide is not a drug-like molecule.

MolName	(E)-N-[5,5-dioxo-7-[[(E)-3-phenylprop-2-enoyl]amino]dibenzothiophen-3-yl]-3-phenylprop-2-enamide
MolecularFormula	C30H22N2O4S
Smiles	O=C(/C=C/c1ccccc1)Nc(cc1)cc2c1-c(ccc(NC(/C=C/c1ccccc1)=O)c1)c1S2(=O)=O
InChI	InChI=1S/C30H22N2O4S/c33-29(17-11-21-7-3-1-4-8-21)31-23-13-15-25-26-16-14-24(20-28(26)37(35,36)27(25)19-23)32-30(34)18-12-22-9-5-2-6-10-22/h1-20H,(H,31,33)(H,32,34)
InChIK	RTMWISIHUOKKTG-UHFFFAOYSA-N
TotalMolweight	506.581
Molweight	506.581
MonoisotopicMass	506.130028
CLogP	5.3062
CLogS	-7.916
H Acceptors	6
H Donors	2
TotalSurfaceArea	379.04
Relative PSA	0.20467
PolarSurfaceArea	100.72
Druglikeness	-2.6734
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.62162
Fragments	1
Non HAtoms	37
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	1
Symmetricatoms	20
Amides	2
StereoCon

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1 - (E)-N-[5,5-dioxo-7-[[(E)-3-phenylprop-2-enoyl]amino]dibenzothiophen-3-yl]-3-phenylprop-2-enamide | 2 - (E)-N-[5,5-dioxo-7-[[(E)-3-phenylprop-2-enoyl]amino]dibenzothiophen-3-yl]-3-phenylprop-2-enamide

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