2-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]acetamide

Formula:C20H18N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]acetamide is a drug-like molecule.

MolName2-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]acetamide
MolecularFormulaC20H18N2O4
SmilesNC(CN(C(C1(CC(/C=C/c2ccccc2)=O)O)=O)c2c1cccc2)=O
InChIInChI=1S/C20H18N2O4/c21-18(24)13-22-17-9-5-4-8-16(17)20(26,19(22)25)12-15(23)11-10-14-6-2-1-3-7-14/h1-11,26H,12-13H2,(H2,21,24)/t20-/m0/s1
InChIKRONPNHXUDQJRIH-FQEVSTJZSA-N
TotalMolweight350.373
Molweight350.373
MonoisotopicMass350.126658
CLogP1.1548
CLogS-3.432
H Acceptors6
H Donors2
TotalSurfaceArea262.37
Relative PSA0.27076
PolarSurfaceArea100.7
Druglikeness6.4011
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.53846
Fragments1
Non HAtoms26
NonCHAtoms6
Electronegative Atoms6
StereoCenters1
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms2
Amides2
StereoConracemate

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