(5R)-2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5H-pyrimidin-4-olate

Formula:C11H7N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5R)-2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5H-pyrimidin-4-olate is a drug-like molecule.

MolName	(5R)-2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5H-pyrimidin-4-olate
MolecularFormula	C11H7N2O4
Smiles	[O-]C([C@@H](/C=C(\C=CC=C1)/C1=O)C(N1)=O)=NC1=O
InChI	InChI=1S/C11H8N2O4/c14-8-4-2-1-3-6(8)5-7-9(15)12-11(17)13-10(7)16/h1-5,7H,(H2,12,13,15,16,17)/p-1/b6-5+
InChIK	AVRFBBWDPAHCPV-AATRIKPKSA-M
TotalMolweight	231.187
Molweight	231.187
MonoisotopicMass	231.040583
CLogP	-2.7938
CLogS	-1.762
H Acceptors	6
H Donors	1
TotalSurfaceArea	171.92
Relative PSA	0.44422
PolarSurfaceArea	98.66
Druglikeness	4.5028
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58824
Fragments	1
Non HAtoms	17
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	1
Rings Closures	2
Small Rings	2
Sp3Atoms	2
Amides	1
StereoCon	this enantiomer

Click to Load Molecule:

1 - (5R)-2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5H-pyrimidin-4-olate | 2 - (5R)-2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5H-pyrimidin-4-olate

Request More Details | (5R)-2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5H-pyrimidin-4-olate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments