Name: 8,9-Difluoro-2-methyl-7-nitro-6-oxo-1,2-dihyro-pyrrolo[3,2,1-ij]quinoline-5-carboxylic acid
SMILES:
CC1Cc2c(F)c(F)c([N+](=O)[O-])c3c(=O)c(C(=O)O)cn1c23Molecular Processing
Molecular formula
C13H8F2N2O5
Molecular weight
310.21
Exact mass
310.0401
XLogP
2
TPSA
102.44
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
70.15
Supplementary Information
Details werden geladen…
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