4-bromo-N-[(Z)-[5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl]methylideneamino]benzenesulfonamide

Formula:C18H12N2O4BrCl3S Mutagenic:high Tumorigenic:high Reproductive Effective:high 4-bromo-N-[(Z)-[5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl]methylideneamino]benzenesulfonamide is not a drug-like molecule.

MolName	4-bromo-N-[(Z)-[5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl]methylideneamino]benzenesulfonamide
MolecularFormula	C18H12N2O4BrCl3S
Smiles	O=S(c(cc1)ccc1Br)(N/N=C\c1ccc(COc(c(Cl)cc(Cl)c2)c2Cl)o1)=O
InChI	InChI=1S/C18H12BrCl3N2O4S/c19-11-1-5-15(6-2-11)29(25,26)24-23-9-13-3-4-14(28-13)10-27-18-16(21)7-12(20)8-17(18)22/h1-9,24H,10H2
InChIK	GKYGYDAOFXVAIQ-UHFFFAOYSA-N
TotalMolweight	538.632
Molweight	538.632
MonoisotopicMass	535.87667
CLogP	5.4111
CLogS	-6.005
H Acceptors	6
H Donors	1
TotalSurfaceArea	335.92
Relative PSA	0.22523
PolarSurfaceArea	89.28
Druglikeness	1.4818
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	6
StereoCon

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