3-benzyl-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Formula:C23H16N2O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:high 3-benzyl-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one is a drug-like molecule.

MolName	3-benzyl-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one
MolecularFormula	C23H16N2O4S2
Smiles	Oc(cc1)cc(O2)c1C(CSC(N(Cc1ccccc1)C1=O)=Nc3c1scc3)=CC2=O
InChI	InChI=1S/C23H16N2O4S2/c26-16-6-7-17-15(10-20(27)29-19(17)11-16)13-31-23-24-18-8-9-30-21(18)22(28)25(23)12-14-4-2-1-3-5-14/h1-11,26H,12-13H2
InChIK	FRVJIRUVEMBOJH-UHFFFAOYSA-N
TotalMolweight	448.522
Molweight	448.522
MonoisotopicMass	448.055148
CLogP	3.4721
CLogS	-4.865
H Acceptors	6
H Donors	1
TotalSurfaceArea	316.56
Relative PSA	0.3225
PolarSurfaceArea	132.74
Druglikeness	2.6245
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	2
Amides	1
StereoCon

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