2-[3-[(Z)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetamide

Formula:C26H20N4O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[3-[(Z)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetamide is a drug-like molecule.

MolName2-[3-[(Z)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetamide
MolecularFormulaC26H20N4O2S
SmilesNC(Cn1c(cccc2)c2c(/C=C(/C(N2c3ccccc3)=O)\S/C2=N\c2ccccc2)c1)=O
InChIInChI=1S/C26H20N4O2S/c27-24(31)17-29-16-18(21-13-7-8-14-22(21)29)15-23-25(32)30(20-11-5-2-6-12-20)26(33-23)28-19-9-3-1-4-10-19/h1-16H,17H2,(H2,27,31)
InChIKPGWIGOUCKCYBTG-UHFFFAOYSA-N
TotalMolweight452.537
Molweight452.537
MonoisotopicMass452.130696
CLogP3.4321
CLogS-5.594
H Acceptors6
H Donors1
TotalSurfaceArea336.33
Relative PSA0.24015
PolarSurfaceArea105.99
Druglikeness5.606
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.45455
Fragments1
Non HAtoms33
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms2
Symmetricatoms4
Amides2
Aromatic Nitrogens1
StereoCon

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