1-[(Z)-thiophen-2-ylmethylideneamino]-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine

Formula:C19H13N5O2S3 Mutagenic:high Tumorigenic:none Reproductive Effective:none 1-[(Z)-thiophen-2-ylmethylideneamino]-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine is a drug-like molecule.

MolName	1-[(Z)-thiophen-2-ylmethylideneamino]-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine
MolecularFormula	C19H13N5O2S3
Smiles	Nc(n(c1nc2ccccc2nc11)/N=C\c2cccs2)c1S(c1cccs1)(=O)=O
InChI	InChI=1S/C19H13N5O2S3/c20-18-17(29(25,26)15-8-4-10-28-15)16-19(23-14-7-2-1-6-13(14)22-16)24(18)21-11-12-5-3-9-27-12/h1-11H,20H2
InChIK	WFMBSKQFCPTUEK-UHFFFAOYSA-N
TotalMolweight	439.543
Molweight	439.543
MonoisotopicMass	439.023135
CLogP	3.5758
CLogS	-8.495
H Acceptors	7
H Donors	1
TotalSurfaceArea	302.44
Relative PSA	0.41294
PolarSurfaceArea	168.09
Druglikeness	4.6264
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.41379
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	23
Sp3Atoms	2
Symmetricatoms	1
Aromatic Nitrogens	3
StereoCon

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