(5E)-5-[(2-bromophenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Formula:C16H11N2O4Br Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[(2-bromophenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-5-[(2-bromophenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C16H11N2O4Br
Smiles	O=C(/C(/C(N1Cc2ccco2)=O)=C\c(cccc2)c2Br)NC1=O
InChI	InChI=1S/C16H11BrN2O4/c17-13-6-2-1-4-10(13)8-12-14(20)18-16(22)19(15(12)21)9-11-5-3-7-23-11/h1-8H,9H2,(H,18,20,22)
InChIK	REWFAXFPNYJOOQ-UHFFFAOYSA-N
TotalMolweight	375.177
Molweight	375.177
MonoisotopicMass	373.990219
CLogP	1.9922
CLogS	-3.881
H Acceptors	6
H Donors	1
TotalSurfaceArea	241.32
Relative PSA	0.28278
PolarSurfaceArea	79.62
Druglikeness	3.7068
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.52174
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Amides	2
StereoCon

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