N'-(4-bromophenyl)sulfonyl-N-(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide

Formula:C19H11N2O3BrCl2S Mutagenic:low Tumorigenic:none Reproductive Effective:none N'-(4-bromophenyl)sulfonyl-N-(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide is a drug-like molecule.

MolName	N'-(4-bromophenyl)sulfonyl-N-(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide
MolecularFormula	C19H11N2O3BrCl2S
Smiles	O=C(C(Cl)=C1)C(Cl)=CC1=N/C(/c1ccccc1)=N\S(c(cc1)ccc1Br)(=O)=O
InChI	InChI=1S/C19H11BrCl2N2O3S/c20-13-6-8-15(9-7-13)28(26,27)24-19(12-4-2-1-3-5-12)23-14-10-16(21)18(25)17(22)11-14/h1-11H
InChIK	YDHZJMSQARQAHD-UHFFFAOYSA-N
TotalMolweight	498.183
Molweight	498.183
MonoisotopicMass	495.905078
CLogP	4.4777
CLogS	-5.814
H Acceptors	5
TotalSurfaceArea	310.68
Relative PSA	0.20806
PolarSurfaceArea	84.31
Druglikeness	-0.012187
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	2-halo-enone
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	8
BasicNitrogens	2
StereoCon

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