methyl (4E)-4-[[4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxopyrrole-3-carboxylate

Formula:C25H25N2O6F Mutagenic:none Tumorigenic:none Reproductive Effective:high methyl (4E)-4-[[4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxopyrrole-3-carboxylate is a drug-like molecule.

MolName	methyl (4E)-4-[[4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxopyrrole-3-carboxylate
MolecularFormula	C25H25N2O6F
Smiles	CC(N(CCOC)C1=O)=C(C(OC)=O)/C1=C\c(cc1)ccc1OCC(Nc(cc1)ccc1F)=O
InChI	InChI=1S/C25H25FN2O6/c1-16-23(25(31)33-3)21(24(30)28(16)12-13-32-2)14-17-4-10-20(11-5-17)34-15-22(29)27-19-8-6-18(26)7-9-19/h4-11,14H,12-13,15H2,1-3H3,(H,27,29)
InChIK	UMZWQSBSWXSTNN-UHFFFAOYSA-N
TotalMolweight	468.48
Molweight	468.48
MonoisotopicMass	468.169666
CLogP	2.5605
CLogS	-3.603
H Acceptors	8
H Donors	1
TotalSurfaceArea	356.57
Relative PSA	0.23594
PolarSurfaceArea	94.17
Druglikeness	1.7769
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	10
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	9
Symmetricatoms	4
Amides	2
StereoCon

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1 - methyl (4E)-4-[[4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxopyrrole-3-carboxylate | 2 - methyl (4E)-4-[[4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxopyrrole-3-carboxylate

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