Cc1c(CN2CCN(C(=O)[C@H](C)O)CC2)sc2c(N3CCOCC3)nc(-c3cnc(N)nc3)nc12
SMILES: Cc1c(CN2CCN(C(=O)[C@H](C)O)CC2)sc2c(N3CCOCC3)nc(-c3cnc(N)nc3)nc12

Molecular Processing

Molecular formula
C23H30N8O3S
Molecular weight
498.61
Exact mass
498.2162
XLogP
0.9
TPSA
133.83
H-bond donors
2
H-bond acceptors
11
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
134.16

Supplementary Information

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