SMILES:
NC1=c2ccoc2=NCN1c1cccc(NC(=O)Nc2ccc3c(c2)CCC3)c1Molecular Processing
Molecular formula
C22H21N5O2
Molecular weight
387.44
Exact mass
387.1695
XLogP
2.53
TPSA
95.89
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
29
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
111.98
Supplementary Information
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