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

Formula:C20H26N7F Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(2-fluorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolNameN-[(Z)-(2-fluorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormulaC20H26N7F
SmilesFc1c(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)cccc1
InChIInChI=1S/C20H26FN7/c21-17-10-4-3-9-16(17)15-22-26-18-23-19(27-11-5-1-6-12-27)25-20(24-18)28-13-7-2-8-14-28/h3-4,9-10,15H,1-2,5-8,11-14H2,(H,23,24,25,26)
InChIKGEGVXKVVMHZMQL-UHFFFAOYSA-N
TotalMolweight383.473
Molweight383.473
MonoisotopicMass383.223371
CLogP6.0293
CLogS-5.633
H Acceptors7
H Donors1
TotalSurfaceArea303.07
Relative PSA0.20781
PolarSurfaceArea69.54
Druglikeness1.532
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.5
Fragments1
Non HAtoms28
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms10
Symmetricatoms10
Aromatic Nitrogens3
BasicNitrogens3
StereoCon

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