SMILES:
O=C(NCC1CCNC1)c1c[nH]c2c(-c3c(OCC4CC4)ccc4c3OCO4)ncnc12Molecular Processing
Molecular formula
C23H25N5O4
Molecular weight
435.48
Exact mass
435.1907
XLogP
2.48
TPSA
110.39
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
32
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
116.98
Supplementary Information
Récupération des détails…
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