(2S)-2-(4-fluorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-2H-pyrrol-5-one

Formula:C24H21N2OF Mutagenic:none Tumorigenic:none Reproductive Effective:none (2S)-2-(4-fluorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-2H-pyrrol-5-one is a drug-like molecule.

MolName(2S)-2-(4-fluorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-2H-pyrrol-5-one
MolecularFormulaC24H21N2OF
SmilesCc(cc1)ccc1NC(C1=O)=C[C@@H](c(cc2)ccc2F)N1c1ccc(C)cc1
InChIInChI=1S/C24H21FN2O/c1-16-3-11-20(12-4-16)26-22-15-23(18-7-9-19(25)10-8-18)27(24(22)28)21-13-5-17(2)6-14-21/h3-15,23,26H,1-2H3/t23-/m0/s1
InChIKMSAKKWXGDVHYGM-QHCPKHFHSA-N
TotalMolweight372.442
Molweight372.442
MonoisotopicMass372.163791
CLogP4.7764
CLogS-5.618
H Acceptors3
H Donors1
TotalSurfaceArea286.87
Relative PSA0.097779
PolarSurfaceArea32.34
Druglikeness1.8205
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms28
NonCHAtoms4
Electronegative Atoms4
StereoCenters1
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
Symmetricatoms6
Amides1
StereoConthis enantiomer

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