SMILES:
COc1nccc2c1ccc1nc3cccc(C(=O)N[C@H](C)CN(C)C)c3nc12Molecular Processing
Molecular formula
C22H23N5O2
Molecular weight
389.46
Exact mass
389.1852
XLogP
3.02
TPSA
80.24
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
114.38
Supplementary Information
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