SMILES:
Cc1c(-c2ccccc2)c(N2CC[C@H](N(C)C)C2)c2oc(CCc3ccccc3)nc2c1C#NMolecular Processing
Molecular formula
C29H30N4O
Molecular weight
450.59
Exact mass
450.242
XLogP
5.6
TPSA
56.3
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
137.05
Supplementary Information
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