SMILES:
Cl.NC1CCN(C(=O)c2ccc(-c3nnc4n3-c3cccnc3Nc3ccccc3-4)cc2)CC1Molecular Processing
Molecular formula
C25H24ClN7O
Molecular weight
473.97
Exact mass
473.1731
XLogP
4.04
TPSA
101.96
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
34
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.2
Molar refractivity
133.67
Supplementary Information
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