(5Z)-1-(2,3-dichlorophenyl)-2-sulfanylidene-5-(thiophen-3-ylmethylidene)-1,3-diazinane-4,6-dione

Formula:C15H8N2O2Cl2S2 Mutagenic:high Tumorigenic:none Reproductive Effective:high (5Z)-1-(2,3-dichlorophenyl)-2-sulfanylidene-5-(thiophen-3-ylmethylidene)-1,3-diazinane-4,6-dione is a drug-like molecule.

MolName	(5Z)-1-(2,3-dichlorophenyl)-2-sulfanylidene-5-(thiophen-3-ylmethylidene)-1,3-diazinane-4,6-dione
MolecularFormula	C15H8N2O2Cl2S2
Smiles	O=C(/C(/C(N1c2cccc(Cl)c2Cl)=O)=C/c2cscc2)NC1=S
InChI	InChI=1S/C15H8Cl2N2O2S2/c16-10-2-1-3-11(12(10)17)19-14(21)9(13(20)18-15(19)22)6-8-4-5-23-7-8/h1-7H,(H,18,20,22)
InChIK	FNBZBJJBIXLSRM-UHFFFAOYSA-N
TotalMolweight	383.279
Molweight	383.279
MonoisotopicMass	381.940422
CLogP	3.5123
CLogS	-5.343
H Acceptors	4
H Donors	1
TotalSurfaceArea	260.98
Relative PSA	0.34275
PolarSurfaceArea	109.74
Druglikeness	3.9623
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Nasty Functions	twice activated DB; thio-amide/urea
Shape Index	0.47826
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Amides	2
StereoCon

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