2-[3-[(Z)-(1-benzyl-2,5-dioxoimidazolidin-4-ylidene)methyl]indol-1-yl]acetamide

Formula:C21H18N4O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[3-[(Z)-(1-benzyl-2,5-dioxoimidazolidin-4-ylidene)methyl]indol-1-yl]acetamide is a drug-like molecule.

MolName2-[3-[(Z)-(1-benzyl-2,5-dioxoimidazolidin-4-ylidene)methyl]indol-1-yl]acetamide
MolecularFormulaC21H18N4O3
SmilesNC(Cn1c(cccc2)c2c(/C=C(/C(N2Cc3ccccc3)=O)\NC2=O)c1)=O
InChIInChI=1S/C21H18N4O3/c22-19(26)13-24-12-15(16-8-4-5-9-18(16)24)10-17-20(27)25(21(28)23-17)11-14-6-2-1-3-7-14/h1-10,12H,11,13H2,(H2,22,26)(H,23,28)
InChIKQYMYEINXAVDRLO-UHFFFAOYSA-N
TotalMolweight374.399
Molweight374.399
MonoisotopicMass374.137891
CLogP1.2934
CLogS-3.441
H Acceptors7
H Donors2
TotalSurfaceArea279.08
Relative PSA0.27329
PolarSurfaceArea97.43
Druglikeness6.1159
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! 5-methylene-imidazolidine-2,4-dione
Shape Index0.53571
Fragments1
Non HAtoms28
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms15
Sp3Atoms2
Symmetricatoms2
Amides3
Aromatic Nitrogens1
StereoCon

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