N-(4-fluorophenyl)-2-[3-[(E)-2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]indol-1-yl]acetamide

Formula:C22H16N5O5F Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(4-fluorophenyl)-2-[3-[(E)-2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]indol-1-yl]acetamide is a drug-like molecule.

MolName	N-(4-fluorophenyl)-2-[3-[(E)-2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]indol-1-yl]acetamide
MolecularFormula	C22H16N5O5F
Smiles	[O-][N+](C(C(N1)=O)=C(/C=C/c2cn(CC(Nc(cc3)ccc3F)=O)c3c2cccc3)NC1=O)=O
InChI	InChI=1S/C22H16FN5O5/c23-14-6-8-15(9-7-14)24-19(29)12-27-11-13(16-3-1-2-4-18(16)27)5-10-17-20(28(32)33)21(30)26-22(31)25-17/h1-11H,12H2,(H,24,29)(H2,25,26,30,31)
InChIK	PSDSNDLFWBHJAH-UHFFFAOYSA-N
TotalMolweight	449.397
Molweight	449.397
MonoisotopicMass	449.113548
CLogP	1.2111
CLogS	-4.887
H Acceptors	10
H Donors	3
TotalSurfaceArea	324.15
Relative PSA	0.34179
PolarSurfaceArea	138.05
Druglikeness	-2.0435
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Symmetricatoms	2
Amides	3
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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