SMILES:
CNC(=O)Nc1ccc(C2=NN(C(=O)NC)C(C)Cc3cc4c(cc32)OCO4)cc1Molecular Processing
Molecular formula
C21H23N5O4
Molecular weight
409.45
Exact mass
409.175
XLogP
2.51
TPSA
104.29
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
112.19
Supplementary Information
Récupération des détails…
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