C#C[C@H](CC(=O)OCC)NC(=O)CN(C(=O)CCCc1ccnc2c1CCCN2)C1CC1
SMILES: C#C[C@H](CC(=O)OCC)NC(=O)CN(C(=O)CCCc1ccnc2c1CCCN2)C1CC1

Molecular Processing

Molecular formula
C24H32N4O4
Molecular weight
440.54
Exact mass
440.2424
XLogP
1.82
TPSA
100.63
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
32
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
120.73

Supplementary Information

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