3-(4-chlorophenyl)sulfonyl-1-[(Z)-pyridin-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxalin-2-amine

Formula:C22H15N6O2ClS Mutagenic:high Tumorigenic:none Reproductive Effective:none 3-(4-chlorophenyl)sulfonyl-1-[(Z)-pyridin-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxalin-2-amine is a drug-like molecule.

MolName	3-(4-chlorophenyl)sulfonyl-1-[(Z)-pyridin-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxalin-2-amine
MolecularFormula	C22H15N6O2ClS
Smiles	Nc(n(c1nc2ccccc2nc11)/N=C\c2ncccc2)c1S(c(cc1)ccc1Cl)(=O)=O
InChI	InChI=1S/C22H15ClN6O2S/c23-14-8-10-16(11-9-14)32(30,31)20-19-22(28-18-7-2-1-6-17(18)27-19)29(21(20)24)26-13-15-5-3-4-12-25-15/h1-13H,24H2
InChIK	YUCDPCPTHPFCIN-UHFFFAOYSA-N
TotalMolweight	462.92
Molweight	462.92
MonoisotopicMass	462.066571
CLogP	3.3792
CLogS	-8.533
H Acceptors	8
H Donors	1
TotalSurfaceArea	324.74
Relative PSA	0.29297
PolarSurfaceArea	124.5
Druglikeness	4.1989
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.46875
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
Symmetricatoms	3
Aromatic Nitrogens	4
StereoCon

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