N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

Formula:C20H25N7Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolNameN-[(Z)-(2,6-dichlorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormulaC20H25N7Cl2
SmilesClc1cccc(Cl)c1/C=N\Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C20H25Cl2N7/c21-16-8-7-9-17(22)15(16)14-23-27-18-24-19(28-10-3-1-4-11-28)26-20(25-18)29-12-5-2-6-13-29/h7-9,14H,1-6,10-13H2,(H,24,25,26,27)
InChIKSCXFDATXLDPCLX-UHFFFAOYSA-N
TotalMolweight434.374
Molweight434.374
MonoisotopicMass433.154847
CLogP7.1405
CLogS-6.791
H Acceptors7
H Donors1
TotalSurfaceArea327.56
Relative PSA0.19227
PolarSurfaceArea69.54
Druglikeness2.8442
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.48276
Fragments1
Non HAtoms29
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms10
Symmetricatoms13
Aromatic Nitrogens3
BasicNitrogens3
StereoCon

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