SMILES:
Cc1c(-c2ccccc2)c(N2CC[C@](C)(N)C2)c2oc(C(=O)N(C)C)nc2c1C#NMolecular Processing
Molecular formula
C23H25N5O2
Molecular weight
403.49
Exact mass
403.2008
XLogP
3.3
TPSA
99.39
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
116.34
Supplementary Information
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