N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]heptanediamide

Formula:C21H22N4O2F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]heptanediamide is not a drug-like molecule.

MolName	N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]heptanediamide
MolecularFormula	C21H22N4O2F2
Smiles	O=C(CCCCCC(N/N=C\c(cc1)ccc1F)=O)N/N=C\c(cc1)ccc1F
InChI	InChI=1S/C21H22F2N4O2/c22-18-10-6-16(7-11-18)14-24-26-20(28)4-2-1-3-5-21(29)27-25-15-17-8-12-19(23)13-9-17/h6-15H,1-5H2,(H,26,28)(H,27,29)
InChIK	RECKJFNRIVPJHM-UHFFFAOYSA-N
TotalMolweight	400.428
Molweight	400.428
MonoisotopicMass	400.171082
CLogP	5.012
CLogS	-6.096
H Acceptors	6
H Donors	2
TotalSurfaceArea	322.46
Relative PSA	0.22335
PolarSurfaceArea	82.92
Druglikeness	-5.4695
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.7931
Fragments	1
Non HAtoms	29
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	10
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	16
StereoCon

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