이름: 1-[3-((S)-4-hydroxy-6-aza-spiro[2.5]oct-6-yl)-propyl]-3-methyl-piperazin-2-one dihydrochloride
SMILES:
CC1NCCN(CCCN2CCC3(CC3)[C@H](O)C2)C1=O.Cl.ClMolecular Processing
Molecular formula
C15H29Cl2N3O2
Molecular weight
354.32
Exact mass
353.1637
XLogP
0.89
TPSA
55.81
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
0
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
3
Fraction Csp3
0.933
Molar refractivity
91.89
Supplementary Information
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