Cc1cccc(NC(=O)Nc2ccc(-c3nn([C@H]4CC[C@@H](N5CCN(C)CC5)CC4)c4ncnc(N)c34)cc2)c1
SMILES: Cc1cccc(NC(=O)Nc2ccc(-c3nn([C@H]4CC[C@@H](N5CCN(C)CC5)CC4)c4ncnc(N)c34)cc2)c1

Molecular Processing

Molecular formula
C30H37N9O
Molecular weight
539.69
Exact mass
539.3121
XLogP
4.76
TPSA
117.23
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
40
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
159.35

Supplementary Information

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