1-N,4-N-bis[(Z)-(2,6-dichlorophenyl)methylideneamino]phthalazine-1,4-diamine

Formula:C22H14N6Cl4 Mutagenic:none Tumorigenic:high Reproductive Effective:high 1-N,4-N-bis[(Z)-(2,6-dichlorophenyl)methylideneamino]phthalazine-1,4-diamine is not a drug-like molecule.

MolName	1-N,4-N-bis[(Z)-(2,6-dichlorophenyl)methylideneamino]phthalazine-1,4-diamine
MolecularFormula	C22H14N6Cl4
Smiles	Clc1cccc(Cl)c1/C=N\Nc(c1ccccc11)nnc1N/N=C\c(c(Cl)ccc1)c1Cl
InChI	InChI=1S/C22H14Cl4N6/c23-17-7-3-8-18(24)15(17)11-27-29-21-13-5-1-2-6-14(13)22(32-31-21)30-28-12-16-19(25)9-4-10-20(16)26/h1-12H,(H,29,31)(H,30,32)
InChIK	JZAICKCVNYTOIS-UHFFFAOYSA-N
TotalMolweight	504.207
Molweight	504.207
MonoisotopicMass	502.003402
CLogP	10.514
CLogS	-9.036
H Acceptors	6
H Donors	2
TotalSurfaceArea	359.02
Relative PSA	0.18907
PolarSurfaceArea	74.56
Druglikeness	2.3845
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5625
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Symmetricatoms	19
Aromatic Nitrogens	2
StereoCon

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