SMILES:
CC[C@@H]1C(=O)N(C)c2cnc(-n3ccnc3Cl)nc2N1C1CCCC1Molecular Processing
Molecular formula
C17H21ClN6O
Molecular weight
360.85
Exact mass
360.1465
XLogP
2.82
TPSA
67.15
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
96.39
Supplementary Information
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