2-N-[(Z)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine

Formula:C27H25N7O2Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine is not a drug-like molecule.

MolName	2-N-[(Z)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine
MolecularFormula	C27H25N7O2Cl2
Smiles	Clc1cc(Cl)c(COc2ccc(/C=N\Nc3nc(N4CCOCC4)nc(Nc4ccccc4)n3)cc2)cc1
InChI	InChI=1S/C27H25Cl2N7O2/c28-21-9-8-20(24(29)16-21)18-38-23-10-6-19(7-11-23)17-30-35-26-32-25(31-22-4-2-1-3-5-22)33-27(34-26)36-12-14-37-15-13-36/h1-11,16-17H,12-15,18H2,(H2,31,32,33,34,35)
InChIK	LPDDAJNOUUYKDX-UHFFFAOYSA-N
TotalMolweight	550.449
Molweight	550.449
MonoisotopicMass	549.144677
CLogP	8.022
CLogS	-7.829
H Acceptors	9
H Donors	2
TotalSurfaceArea	412.94
Relative PSA	0.2201
PolarSurfaceArea	96.79
Druglikeness	3.4415
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.57895
Fragments	1
Non HAtoms	38
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	7
Symmetricatoms	6
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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1 - 2-N-[(Z)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine | 2 - 2-N-[(Z)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine

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