(Z,1Z)-N-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-3-phenylprop-2-enehydrazonoyl bromide

Formula:C20H24N7O2Br Mutagenic:high Tumorigenic:high Reproductive Effective:high (Z,1Z)-N-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-3-phenylprop-2-enehydrazonoyl bromide is a drug-like molecule.

MolName	(Z,1Z)-N-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-3-phenylprop-2-enehydrazonoyl bromide
MolecularFormula	C20H24N7O2Br
Smiles	Br/C(/C=C\c1ccccc1)=N\Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChI	InChI=1S/C20H24BrN7O2/c21-17(7-6-16-4-2-1-3-5-16)25-26-18-22-19(27-8-12-29-13-9-27)24-20(23-18)28-10-14-30-15-11-28/h1-7H,8-15H2,(H,22,23,24,26)
InChIK	QEJRAQJWLWLEOF-UHFFFAOYSA-N
TotalMolweight	474.362
Molweight	474.362
MonoisotopicMass	473.117484
CLogP	3.9944
CLogS	-3.818
H Acceptors	9
H Donors	1
TotalSurfaceArea	332.54
Relative PSA	0.24953
PolarSurfaceArea	88
Druglikeness	-1.4039
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	acyl-halogenide type
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	12
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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