N-[(Z)-[4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine

Formula:C32H36N6O Mutagenic:low Tumorigenic:high Reproductive Effective:none N-[(Z)-[4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-[4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine
MolecularFormula	C32H36N6O
Smiles	C(c1cccc2ccccc12)Oc1ccc(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)c2)cc1
InChI	InChI=1S/C32H36N6O/c1-5-18-37(19-6-1)31-22-30(34-32(35-31)38-20-7-2-8-21-38)36-33-23-25-14-16-28(17-15-25)39-24-27-12-9-11-26-10-3-4-13-29(26)27/h3-4,9-17,22-23H,1-2,5-8,18-21,24H2,(H,34,35,36)
InChIK	ACLAJAJYZXPPDG-UHFFFAOYSA-N
TotalMolweight	520.679
Molweight	520.679
MonoisotopicMass	520.295059
CLogP	8.5585
CLogS	-8.397
H Acceptors	7
H Donors	1
TotalSurfaceArea	416.08
Relative PSA	0.14903
PolarSurfaceArea	65.88
Druglikeness	2.2354
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.53846
Fragments	1
Non HAtoms	39
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	12
Symmetricatoms	6
Aromatic Nitrogens	2
BasicNitrogens	2
StereoCon

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