Name: 9-methyl-6-oxo-6,7,8,9-tetrahydropyrido[3′,2′:4,5]pyrrolo[1,2-a]pyrazine-2-carboxylate
SMILES:
CC1CNC(=O)c2cc3ccc(C(=O)[O-])nc3n21Molecular Processing
Molecular formula
C12H10N3O3-
Molecular weight
244.23
Exact mass
244.0728
XLogP
-0.3
TPSA
87.05
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
-1
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
61.11
Supplementary Information
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