SMILES:
CC(C)(C)OC(=O)Nc1nc2ccc(Sc3nnc4ccc(N5CCOCC5)nn34)cc2s1Molecular Processing
Molecular formula
C21H23N7O3S2
Molecular weight
485.6
Exact mass
485.1304
XLogP
4.07
TPSA
106.77
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
127.41
Supplementary Information
Obteniendo detalles…
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