(2,5-dioxopyrrolidin-1-yl) 7-hydroxy-2-oxochromene-3-carboxylate

Formula:C14H9NO7 Mutagenic:high Tumorigenic:high Reproductive Effective:none (2,5-dioxopyrrolidin-1-yl) 7-hydroxy-2-oxochromene-3-carboxylate is a drug-like molecule.

MolName	(2,5-dioxopyrrolidin-1-yl) 7-hydroxy-2-oxochromene-3-carboxylate
MolecularFormula	C14H9NO7
Smiles	Oc(cc1)cc(O2)c1C=C(C(ON(C(CC1)=O)C1=O)=O)C2=O
InChI	InChI=1S/C14H9NO7/c16-8-2-1-7-5-9(13(19)21-10(7)6-8)14(20)22-15-11(17)3-4-12(15)18/h1-2,5-6,16H,3-4H2
InChIK	KFEBWCYYRFZMTJ-UHFFFAOYSA-N
TotalMolweight	303.225
Molweight	303.225
MonoisotopicMass	303.037904
CLogP	-0.5155
CLogS	-2.097
H Acceptors	8
H Donors	1
TotalSurfaceArea	206.14
Relative PSA	0.43082
PolarSurfaceArea	110.21
Druglikeness	-23.777
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB; N-acyloxy-amide
Shape Index	0.54545
Fragments	1
Non HAtoms	22
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	5
Symmetricatoms	3
StereoCon

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