N-(2-chlorophenyl)-2-[2-[(E)-[1-(4-hydroxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide

Formula:C25H18N3O6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high N-(2-chlorophenyl)-2-[2-[(E)-[1-(4-hydroxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide is a drug-like molecule.

MolName	N-(2-chlorophenyl)-2-[2-[(E)-[1-(4-hydroxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide
MolecularFormula	C25H18N3O6Cl
Smiles	Oc(cc1)ccc1N(C(/C(/C(N1)=O)=C/c(cccc2)c2OCC(Nc(cccc2)c2Cl)=O)=O)C1=O
InChI	InChI=1S/C25H18ClN3O6/c26-19-6-2-3-7-20(19)27-22(31)14-35-21-8-4-1-5-15(21)13-18-23(32)28-25(34)29(24(18)33)16-9-11-17(30)12-10-16/h1-13,30H,14H2,(H,27,31)(H,28,32,34)
InChIK	KVQKQJKBXNOHQY-UHFFFAOYSA-N
TotalMolweight	491.886
Molweight	491.886
MonoisotopicMass	491.088414
CLogP	3.1381
CLogS	-5.619
H Acceptors	9
H Donors	3
TotalSurfaceArea	353.74
Relative PSA	0.28758
PolarSurfaceArea	125.04
Druglikeness	4.7716
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Nasty Functions	twice activated DB
Shape Index	0.54286
Fragments	1
Non HAtoms	35
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	2
Amides	3
StereoCon

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1 - N-(2-chlorophenyl)-2-[2-[(E)-[1-(4-hydroxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide | 2 - N-(2-chlorophenyl)-2-[2-[(E)-[1-(4-hydroxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide

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