CCCCCCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1.Cl
SMILES: CCCCCCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1.Cl

Molecular Processing

Molecular formula
C31H38ClN7O3
Molecular weight
592.14
Exact mass
591.2725
XLogP
5.45
TPSA
139.22
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
42
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.323
Molar refractivity
168.38

Supplementary Information

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