SMILES:
CCNC(=O)C1OC(n2cnc3c(N)nc(C#CCC4CCC(C(N)=O)CC4)nc32)C(O)C1OMolecular Processing
Molecular formula
C22H29N7O5
Molecular weight
471.52
Exact mass
471.223
XLogP
-0.8
TPSA
191.5
H-bond donors
5
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.591
Molar refractivity
120.48
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→