4-(6-chloro-2-oxochromen-3-yl)-7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)chromen-2-one

Formula:C23H19NO6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high 4-(6-chloro-2-oxochromen-3-yl)-7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)chromen-2-one is a drug-like molecule.

MolName	4-(6-chloro-2-oxochromen-3-yl)-7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)chromen-2-one
MolecularFormula	C23H19NO6Cl
Smiles	Oc(cc1)c(C[NH+]2CCOCC2)c(O2)c1C(C1=Cc(cc(cc3)Cl)c3OC1=O)=CC2=O
InChI	InChI=1S/C23H18ClNO6/c24-14-1-4-20-13(9-14)10-17(23(28)30-20)16-11-21(27)31-22-15(16)2-3-19(26)18(22)12-25-5-7-29-8-6-25/h1-4,9-11,26H,5-8,12H2/p+1
InChIK	BMMQZOXLNLHZPI-UHFFFAOYSA-O
TotalMolweight	440.858
Molweight	440.858
MonoisotopicMass	440.090091
CLogP	0.2785
CLogS	-3.63
H Acceptors	7
H Donors	2
TotalSurfaceArea	322.35
Relative PSA	0.26918
PolarSurfaceArea	86.5
Druglikeness	-3.5962
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
StereoCon

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