이름: 8-(4-Cyclopropyl-2-fluoro-phenylamino)-imidazo[1,5-a]pyridine-7-carboxylic acid (2-vinyloxy-ethoxy)-amide
SMILES:
C=COCCONC(=O)c1ccn2cncc2c1Nc1ccc(C2CC2)cc1FMolecular Processing
Molecular formula
C21H21FN4O3
Molecular weight
396.42
Exact mass
396.1598
XLogP
3.92
TPSA
76.89
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
106.42
Supplementary Information
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