N-[(Z)-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine

Formula:C28H32N6OClF Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine
MolecularFormula	C28H32N6OClF
Smiles	Fc1ccc(COc(cc2)c(/C=N\Nc3nc(N4CCCCC4)nc(N4CCCCC4)c3)cc2Cl)cc1
InChI	InChI=1S/C28H32ClFN6O/c29-23-9-12-25(37-20-21-7-10-24(30)11-8-21)22(17-23)19-31-34-26-18-27(35-13-3-1-4-14-35)33-28(32-26)36-15-5-2-6-16-36/h7-12,17-19H,1-6,13-16,20H2,(H,32,33,34)
InChIK	OKYVIQKQLNEVFZ-UHFFFAOYSA-N
TotalMolweight	523.054
Molweight	523.054
MonoisotopicMass	522.231014
CLogP	8.0709
CLogS	-7.841
H Acceptors	7
H Donors	1
TotalSurfaceArea	403.25
Relative PSA	0.15378
PolarSurfaceArea	65.88
Druglikeness	0.90847
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.51351
Fragments	1
Non HAtoms	37
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	12
Symmetricatoms	6
Aromatic Nitrogens	2
BasicNitrogens	2
StereoCon

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