이름: 2-benzylamino-2-(6-benzyloxy-3,4-dihydro-naphthalen-2-yl)-propane-1,3-diol
SMILES:
OCC(CO)(NCc1ccccc1)C1=Cc2ccc(OCc3ccccc3)cc2CC1Molecular Processing
Molecular formula
C27H29NO3
Molecular weight
415.53
Exact mass
415.2147
XLogP
4.11
TPSA
61.72
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.259
Molar refractivity
123.7
Supplementary Information
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