N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2,6-dimorpholin-4-ylpyrimidin-4-amine

Formula:C23H25N6O3Br Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2,6-dimorpholin-4-ylpyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2,6-dimorpholin-4-ylpyrimidin-4-amine
MolecularFormula	C23H25N6O3Br
Smiles	Brc(cc1)ccc1-c1ccc(/C=N\Nc2nc(N3CCOCC3)nc(N3CCOCC3)c2)o1
InChI	InChI=1S/C23H25BrN6O3/c24-18-3-1-17(2-4-18)20-6-5-19(33-20)16-25-28-21-15-22(29-7-11-31-12-8-29)27-23(26-21)30-9-13-32-14-10-30/h1-6,15-16H,7-14H2,(H,26,27,28)
InChIK	MKCAXHLBNLTNDD-UHFFFAOYSA-N
TotalMolweight	513.395
Molweight	513.395
MonoisotopicMass	512.11715
CLogP	5.3521
CLogS	-5.966
H Acceptors	9
H Donors	1
TotalSurfaceArea	358.52
Relative PSA	0.24021
PolarSurfaceArea	88.25
Druglikeness	3.3847
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	10
Symmetricatoms	6
Aromatic Nitrogens	2
BasicNitrogens	2
StereoCon

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