SMILES:
CC(C)CS(=O)(=O)Oc1cc(Cc2cnc(N)nc2N)cc2c1ccn2CMolecular Processing
Molecular formula
C18H23N5O3S
Molecular weight
389.48
Exact mass
389.1522
XLogP
2.09
TPSA
126.12
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
105.83
Supplementary Information
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