2-N-[(E)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-4-N-(4-fluorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

Formula:C24H21N7O2ClF Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-N-[(E)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-4-N-(4-fluorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is not a drug-like molecule.

MolName	2-N-[(E)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-4-N-(4-fluorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
MolecularFormula	C24H21N7O2ClF
Smiles	Fc(cc1)ccc1Nc1nc(N/N=C/c2ccc(-c3cccc(Cl)c3)o2)nc(N2CCOCC2)n1
InChI	InChI=1S/C24H21ClFN7O2/c25-17-3-1-2-16(14-17)21-9-8-20(35-21)15-27-32-23-29-22(28-19-6-4-18(26)5-7-19)30-24(31-23)33-10-12-34-13-11-33/h1-9,14-15H,10-13H2,(H2,28,29,30,31,32)
InChIK	JBVCSBQZYPOPOQ-UHFFFAOYSA-N
TotalMolweight	493.929
Molweight	493.929
MonoisotopicMass	493.142928
CLogP	7.1076
CLogS	-7.526
H Acceptors	9
H Donors	2
TotalSurfaceArea	369.8
Relative PSA	0.2569
PolarSurfaceArea	100.7
Druglikeness	3.9771
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.54286
Fragments	1
Non HAtoms	35
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	5
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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1 - 2-N-[(E)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-4-N-(4-fluorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine | 2 - 2-N-[(E)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-4-N-(4-fluorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

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