2-[4-bromo-2-[(Z)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide

Formula:C19H13N3O5BrCl Mutagenic:high Tumorigenic:none Reproductive Effective:high 2-[4-bromo-2-[(Z)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide is a drug-like molecule.

MolName	2-[4-bromo-2-[(Z)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide
MolecularFormula	C19H13N3O5BrCl
Smiles	NC(COc(cc1)c(/C=C(/C(NC(N2c3cc(Cl)ccc3)=O)=O)\C2=O)cc1Br)=O
InChI	InChI=1S/C19H13BrClN3O5/c20-11-4-5-15(29-9-16(22)25)10(6-11)7-14-17(26)23-19(28)24(18(14)27)13-3-1-2-12(21)8-13/h1-8H,9H2,(H2,22,25)(H,23,26,28)
InChIK	SOMXDZZHMGBVRO-UHFFFAOYSA-N
TotalMolweight	478.685
Molweight	478.685
MonoisotopicMass	476.97271
CLogP	2.1488
CLogS	-5.326
H Acceptors	8
H Donors	2
TotalSurfaceArea	303.32
Relative PSA	0.30476
PolarSurfaceArea	118.8
Druglikeness	3.3592
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Amides	3
StereoCon

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