4-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]butanoate

Formula:C15H14NO6 Mutagenic:none Tumorigenic:none Reproductive Effective:high 4-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]butanoate is a drug-like molecule.

MolName	4-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]butanoate
MolecularFormula	C15H14NO6
Smiles	[O-]C(CCCNC(CC(c(ccc(O)c1)c1O1)=CC1=O)=O)=O
InChI	InChI=1S/C15H15NO6/c17-10-3-4-11-9(7-15(21)22-12(11)8-10)6-13(18)16-5-1-2-14(19)20/h3-4,7-8,17H,1-2,5-6H2,(H,16,18)(H,19,20)/p-1
InChIK	CDSJWJFVBNSPEQ-UHFFFAOYSA-M
TotalMolweight	304.277
Molweight	304.277
MonoisotopicMass	304.082114
CLogP	-1.6755
CLogS	-1.855
H Acceptors	7
H Donors	2
TotalSurfaceArea	228.1
Relative PSA	0.38562
PolarSurfaceArea	115.76
Druglikeness	-1.5948
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	7
Amides	1
AcidicOxygens	1
StereoCon

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