名称: product
SMILES:
COC(=O)c1ccc(Cc2c(C)nc(N)nc2O)c(OCc2ccccc2)c1Molecular Processing
Molecular formula
C21H21N3O4
Molecular weight
379.42
Exact mass
379.1532
XLogP
3.03
TPSA
107.56
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
104.21
Supplementary Information
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