[4-[(Z)-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]phenyl] 4-fluorobenzoate

Formula:C27H30N7O2F Mutagenic:high Tumorigenic:high Reproductive Effective:high [4-[(Z)-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]phenyl] 4-fluorobenzoate is not a drug-like molecule.

MolName	[4-[(Z)-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]phenyl] 4-fluorobenzoate
MolecularFormula	C27H30N7O2F
Smiles	O=C(c(cc1)ccc1F)Oc1ccc(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)cc1
InChI	InChI=1S/C27H30FN7O2/c28-22-11-9-21(10-12-22)24(36)37-23-13-7-20(8-14-23)19-29-33-25-30-26(34-15-3-1-4-16-34)32-27(31-25)35-17-5-2-6-18-35/h7-14,19H,1-6,15-18H2,(H,30,31,32,33)
InChIK	UHZXHCWLVPEHAC-UHFFFAOYSA-N
TotalMolweight	503.58
Molweight	503.58
MonoisotopicMass	503.244501
CLogP	7.4598
CLogS	-7.103
H Acceptors	9
H Donors	1
TotalSurfaceArea	390.58
Relative PSA	0.22024
PolarSurfaceArea	95.84
Druglikeness	0.8462
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.56757
Fragments	1
Non HAtoms	37
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	11
Symmetricatoms	14
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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