3-[2-[(E)-1-benzamido-2-(2-hydroxyphenyl)ethenyl]-5-oxo-1,3-oxazolidin-4-yl]propanoic acid

Formula:C21H20N2O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[2-[(E)-1-benzamido-2-(2-hydroxyphenyl)ethenyl]-5-oxo-1,3-oxazolidin-4-yl]propanoic acid is a drug-like molecule.

MolName	3-[2-[(E)-1-benzamido-2-(2-hydroxyphenyl)ethenyl]-5-oxo-1,3-oxazolidin-4-yl]propanoic acid
MolecularFormula	C21H20N2O6
Smiles	OC(CCC1NC(/C(/NC(c2ccccc2)=O)=C\c(cccc2)c2O)OC1=O)=O
InChI	InChI=1S/C21H20N2O6/c24-17-9-5-4-8-14(17)12-16(22-19(27)13-6-2-1-3-7-13)20-23-15(21(28)29-20)10-11-18(25)26/h1-9,12,15,20,23-24H,10-11H2,(H,22,27)(H,25,26)/b16-12+
InChIK	SZUSGTAVUCUOSO-FOWTUZBSSA-N
TotalMolweight	396.398
Molweight	396.398
MonoisotopicMass	396.132138
CLogP	0.1072
CLogS	-3.551
H Acceptors	8
H Donors	4
TotalSurfaceArea	295.62
Relative PSA	0.33232
PolarSurfaceArea	124.96
Druglikeness	2.3139
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	2
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	2
Amides	1
BasicNitrogens	1
AcidicOxygens	1
StereoCon	unknown chirality

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1 - 3-[2-[(E)-1-benzamido-2-(2-hydroxyphenyl)ethenyl]-5-oxo-1,3-oxazolidin-4-yl]propanoic acid | 2 - 3-[2-[(E)-1-benzamido-2-(2-hydroxyphenyl)ethenyl]-5-oxo-1,3-oxazolidin-4-yl]propanoic acid

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