SMILES:
CCN1CCC(NC(=O)c2ccc(Nc3ncc4c(n3)N(C3CCCC3)CC3(CC3)C(=O)N4C)c(OC)c2)CC1Molecular Processing
Molecular formula
C30H41N7O3
Molecular weight
547.7
Exact mass
547.3271
XLogP
3.95
TPSA
102.93
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
40
Rings
6
Aromatic rings
2
Saturated rings
3
Aliphatic rings
4
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
155.59
Supplementary Information
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