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

Formula:C21H16N3O4F Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[1-[(2-fluorophenyl)methyl]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)methyl]pyrrol-2-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C21H16N3O4F
Smiles	O=C(/C(/C(N1Cc2ccco2)=O)=C\c2cccn2Cc(cccc2)c2F)NC1=O
InChI	InChI=1S/C21H16FN3O4/c22-18-8-2-1-5-14(18)12-24-9-3-6-15(24)11-17-19(26)23-21(28)25(20(17)27)13-16-7-4-10-29-16/h1-11H,12-13H2,(H,23,26,28)
InChIK	IRZWBSFVDXWTFQ-UHFFFAOYSA-N
TotalMolweight	393.373
Molweight	393.373
MonoisotopicMass	393.112485
CLogP	1.6346
CLogS	-2.862
H Acceptors	7
H Donors	1
TotalSurfaceArea	291.76
Relative PSA	0.25744
PolarSurfaceArea	84.55
Druglikeness	4.3352
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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