N,N'-bis[(Z)-(5-bromofuran-2-yl)methylideneamino]nonanediamide

Formula:C19H22N4O4Br2 Mutagenic:high Tumorigenic:high Reproductive Effective:none N,N'-bis[(Z)-(5-bromofuran-2-yl)methylideneamino]nonanediamide is not a drug-like molecule.

MolName	N,N'-bis[(Z)-(5-bromofuran-2-yl)methylideneamino]nonanediamide
MolecularFormula	C19H22N4O4Br2
Smiles	O=C(CCCCCCCC(N/N=C\c(o1)ccc1Br)=O)N/N=C\c(o1)ccc1Br
InChI	InChI=1S/C19H22Br2N4O4/c20-16-10-8-14(28-16)12-22-24-18(26)6-4-2-1-3-5-7-19(27)25-23-13-15-9-11-17(21)29-15/h8-13H,1-7H2,(H,24,26)(H,25,27)
InChIK	OCYISRXBTMDOJM-UHFFFAOYSA-N
TotalMolweight	530.216
Molweight	530.216
MonoisotopicMass	528.000778
CLogP	5.7418
CLogS	-6.566
H Acceptors	8
H Donors	2
TotalSurfaceArea	353.92
Relative PSA	0.28323
PolarSurfaceArea	109.2
Druglikeness	-5.3033
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.7931
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	12
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	7
Symmetricatoms	14
StereoCon

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