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

Formula:C22H23N7OCl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(3,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-(3,5-dichlorophenyl)furan-2-yl]methylideneamino]-4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-amine
MolecularFormula	C22H23N7OCl2
Smiles	Clc1cc(-c2ccc(/C=N\Nc3nc(N4CCCC4)nc(N4CCCC4)n3)o2)cc(Cl)c1
InChI	InChI=1S/C22H23Cl2N7O/c23-16-11-15(12-17(24)13-16)19-6-5-18(32-19)14-25-29-20-26-21(30-7-1-2-8-30)28-22(27-20)31-9-3-4-10-31/h5-6,11-14H,1-4,7-10H2,(H,26,27,28,29)
InChIK	ZFSDBDNRFMBWFS-UHFFFAOYSA-N
TotalMolweight	472.379
Molweight	472.379
MonoisotopicMass	471.134112
CLogP	7.3954
CLogS	-7.711
H Acceptors	8
H Donors	1
TotalSurfaceArea	349.49
Relative PSA	0.22058
PolarSurfaceArea	82.68
Druglikeness	5.8366
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	8
Symmetricatoms	12
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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

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