(5E)-5-[(1-benzylindol-3-yl)methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione

Formula:C26H18N3O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[(1-benzylindol-3-yl)methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-5-[(1-benzylindol-3-yl)methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C26H18N3O3Cl
Smiles	O=C(/C(/C(N1c(cccc2)c2Cl)=O)=C\c2cn(Cc3ccccc3)c3c2cccc3)NC1=O
InChI	InChI=1S/C26H18ClN3O3/c27-21-11-5-7-13-23(21)30-25(32)20(24(31)28-26(30)33)14-18-16-29(15-17-8-2-1-3-9-17)22-12-6-4-10-19(18)22/h1-14,16H,15H2,(H,28,31,33)
InChIK	VUKPYIUBSVFYOA-UHFFFAOYSA-N
TotalMolweight	455.9
Molweight	455.9
MonoisotopicMass	455.103669
CLogP	4.2911
CLogS	-5.601
H Acceptors	6
H Donors	1
TotalSurfaceArea	331.98
Relative PSA	0.18375
PolarSurfaceArea	71.41
Druglikeness	5.5972
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Nasty Functions	twice activated DB
Shape Index	0.48485
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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