SMILES:
Cc1[nH]c(C=NN=C2C(=O)Nc3ccccc32)c(C)c1C(=O)NCCNc1ccc(C(=O)Nc2ccccc2N)cn1Molecular Processing
Molecular formula
C30H29N9O3
Molecular weight
563.62
Exact mass
563.2393
XLogP
3.48
TPSA
178.75
H-bond donors
6
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
42
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
163.34
Supplementary Information
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