N-[(Z)-(2-iodophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

Formula:C20H26N7I Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(2-iodophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-(2-iodophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormula	C20H26N7I
Smiles	Ic1c(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)cccc1
InChI	InChI=1S/C20H26IN7/c21-17-10-4-3-9-16(17)15-22-26-18-23-19(27-11-5-1-6-12-27)25-20(24-18)28-13-7-2-8-14-28/h3-4,9-10,15H,1-2,5-8,11-14H2,(H,23,24,25,26)
InChIK	ODCBCHOARUDIGC-UHFFFAOYSA-N
TotalMolweight	491.375
Molweight	491.375
MonoisotopicMass	491.129441
CLogP	6.3656
CLogS	-6.335
H Acceptors	7
H Donors	1
TotalSurfaceArea	323
Relative PSA	0.19498
PolarSurfaceArea	69.54
Druglikeness	3.2471
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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