2-N-[(Z)-(2-bromophenyl)methylideneamino]-4-N-(4-chlorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

Formula:C20H19N7OBrCl Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-(2-bromophenyl)methylideneamino]-4-N-(4-chlorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is not a drug-like molecule.

MolName	2-N-[(Z)-(2-bromophenyl)methylideneamino]-4-N-(4-chlorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
MolecularFormula	C20H19N7OBrCl
Smiles	Clc(cc1)ccc1Nc1nc(N/N=C\c(cccc2)c2Br)nc(N2CCOCC2)n1
InChI	InChI=1S/C20H19BrClN7O/c21-17-4-2-1-3-14(17)13-23-28-19-25-18(24-16-7-5-15(22)6-8-16)26-20(27-19)29-9-11-30-12-10-29/h1-8,13H,9-12H2,(H2,24,25,26,27,28)
InChIK	HZZYMYFWMGDYMD-UHFFFAOYSA-N
TotalMolweight	488.776
Molweight	488.776
MonoisotopicMass	487.052296
CLogP	6.7931
CLogS	-6.586
H Acceptors	8
H Donors	2
TotalSurfaceArea	332.63
Relative PSA	0.24318
PolarSurfaceArea	87.56
Druglikeness	1.6515
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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1 - 2-N-[(Z)-(2-bromophenyl)methylideneamino]-4-N-(4-chlorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine | 2 - 2-N-[(Z)-(2-bromophenyl)methylideneamino]-4-N-(4-chlorophenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

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