N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

Formula:C22H23N7O3Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
MolecularFormula	C22H23N7O3Cl2
Smiles	Clc(cc1)cc(-c2ccc(/C=N\Nc3nc(N4CCOCC4)nc(N4CCOCC4)n3)o2)c1Cl
InChI	InChI=1S/C22H23Cl2N7O3/c23-15-1-3-18(24)17(13-15)19-4-2-16(34-19)14-25-29-20-26-21(30-5-9-32-10-6-30)28-22(27-20)31-7-11-33-12-8-31/h1-4,13-14H,5-12H2,(H,26,27,28,29)
InChIK	OSAIWTNDDIDVKX-UHFFFAOYSA-N
TotalMolweight	504.377
Molweight	504.377
MonoisotopicMass	503.123942
CLogP	5.7514
CLogS	-6.473
H Acceptors	10
H Donors	1
TotalSurfaceArea	369.49
Relative PSA	0.26277
PolarSurfaceArea	101.14
Druglikeness	5.1983
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	34
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	10
Symmetricatoms	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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1 - N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine | 2 - N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

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