(2S)-2-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]-3-phenylpropanoate

Formula:C20H16NO6 Mutagenic:none Tumorigenic:none Reproductive Effective:high (2S)-2-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]-3-phenylpropanoate is a drug-like molecule.

MolName	(2S)-2-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]-3-phenylpropanoate
MolecularFormula	C20H16NO6
Smiles	[O-]C([C@H](Cc1ccccc1)NC(CC(c(ccc(O)c1)c1O1)=CC1=O)=O)=O
InChI	InChI=1S/C20H17NO6/c22-14-6-7-15-13(10-19(24)27-17(15)11-14)9-18(23)21-16(20(25)26)8-12-4-2-1-3-5-12/h1-7,10-11,16,22H,8-9H2,(H,21,23)(H,25,26)/p-1/t16-/m0/s1
InChIK	TUXAPVMPIFDOLA-INIZCTEOSA-M
TotalMolweight	366.348
Molweight	366.348
MonoisotopicMass	366.097764
CLogP	-0.7831
CLogS	-2.828
H Acceptors	7
H Donors	2
TotalSurfaceArea	272.84
Relative PSA	0.32239
PolarSurfaceArea	115.76
Druglikeness	1.7044
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon	this enantiomer

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