Name: 4-[(glycylamino)methyl]-1-(4-methylthiobenzyl)piperidine
SMILES:
CSc1ccc(CN2CCC(CNC(=O)CN)CC2)cc1Molecular Processing
Molecular formula
C16H25N3OS
Molecular weight
307.46
Exact mass
307.1718
XLogP
1.7
TPSA
58.36
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
88.29
Supplementary Information
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