2-[3-[(E)-[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide

Formula:C21H15N4O4F Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[3-[(E)-[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide is a drug-like molecule.

MolName	2-[3-[(E)-[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide
MolecularFormula	C21H15N4O4F
Smiles	NC(Cn1c(cccc2)c2c(/C=C(\C(NC(N2c(cccc3)c3F)=O)=O)/C2=O)c1)=O
InChI	InChI=1S/C21H15FN4O4/c22-15-6-2-4-8-17(15)26-20(29)14(19(28)24-21(26)30)9-12-10-25(11-18(23)27)16-7-3-1-5-13(12)16/h1-10H,11H2,(H2,23,27)(H,24,28,30)
InChIK	BKNULSYARKDQRE-UHFFFAOYSA-N
TotalMolweight	406.372
Molweight	406.372
MonoisotopicMass	406.107734
CLogP	1.0103
CLogS	-3.945
H Acceptors	8
H Donors	2
TotalSurfaceArea	289.42
Relative PSA	0.30858
PolarSurfaceArea	114.5
Druglikeness	5.2763
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	1
Amides	3
Aromatic Nitrogens	1
StereoCon

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