N-[(Z)-[3,5-dichloro-2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine

Formula:C26H27N6OCl3 Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[(Z)-[3,5-dichloro-2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-[3,5-dichloro-2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine
MolecularFormula	C26H27N6OCl3
Smiles	Clc(cc1/C=N\Nc2nc(N3CCCC3)nc(N3CCCC3)c2)cc(Cl)c1OCc(cccc1)c1Cl
InChI	InChI=1S/C26H27Cl3N6O/c27-20-13-19(25(22(29)14-20)36-17-18-7-1-2-8-21(18)28)16-30-33-23-15-24(34-9-3-4-10-34)32-26(31-23)35-11-5-6-12-35/h1-2,7-8,13-16H,3-6,9-12,17H2,(H,31,32,33)
InChIK	JHTQUVBVUXWYRT-UHFFFAOYSA-N
TotalMolweight	545.9
Molweight	545.9
MonoisotopicMass	544.13119
CLogP	8.4981
CLogS	-8.459
H Acceptors	7
H Donors	1
TotalSurfaceArea	400.22
Relative PSA	0.15494
PolarSurfaceArea	65.88
Druglikeness	3.6858
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.47222
Fragments	1
Non HAtoms	36
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	10
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	2
StereoCon

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