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

Formula:C20H14N3O4F Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[1-(2-fluorophenyl)pyrrol-2-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-5-[[1-(2-fluorophenyl)pyrrol-2-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C20H14N3O4F
Smiles	O=C(/C(/C(N1Cc2ccco2)=O)=C\c2cccn2-c(cccc2)c2F)NC1=O
InChI	InChI=1S/C20H14FN3O4/c21-16-7-1-2-8-17(16)23-9-3-5-13(23)11-15-18(25)22-20(27)24(19(15)26)12-14-6-4-10-28-14/h1-11H,12H2,(H,22,25,27)
InChIK	NTTAVCXXJFWURM-UHFFFAOYSA-N
TotalMolweight	379.346
Molweight	379.346
MonoisotopicMass	379.096835
CLogP	1.6067
CLogS	-5.698
H Acceptors	7
H Donors	1
TotalSurfaceArea	278
Relative PSA	0.27018
PolarSurfaceArea	84.55
Druglikeness	4.3352
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
Amides	2
Aromatic Nitrogens	1
StereoCon

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