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

Formula:C22H23N7O2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(2,4-dichlorophenyl)furan-2-yl]methylideneamino]-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-(2,4-dichlorophenyl)furan-2-yl]methylideneamino]-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
MolecularFormula	C22H23N7O2Cl2
Smiles	Clc(cc1)cc(Cl)c1-c1ccc(/C=N\Nc2nc(N3CCOCC3)nc(N3CCCC3)n2)o1
InChI	InChI=1S/C22H23Cl2N7O2/c23-15-3-5-17(18(24)13-15)19-6-4-16(33-19)14-25-29-20-26-21(30-7-1-2-8-30)28-22(27-20)31-9-11-32-12-10-31/h3-6,13-14H,1-2,7-12H2,(H,26,27,28,29)
InChIK	DCZPOYPTNNTYIF-UHFFFAOYSA-N
TotalMolweight	488.378
Molweight	488.378
MonoisotopicMass	487.129027
CLogP	6.5734
CLogS	-7.092
H Acceptors	9
H Donors	1
TotalSurfaceArea	359.49
Relative PSA	0.24226
PolarSurfaceArea	91.91
Druglikeness	4.8795
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	9
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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

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