Название: 4-cyclohexyl-1-[2-[ethoxy(4-phenylbutyl)phosphoryl]acetyl]pyrrolidine-2-carboxylic acid
SMILES:
CCOP(=O)(CCCCC1=CC=CC=C1)CC(=O)N2CC(CC2C(=O)O)C3CCCCC3Molecular Processing
Molecular formula
C25H38NO5P
Molecular weight
463.56
Exact mass
463.2488
XLogP
5.21
TPSA
83.91
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
32
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.68
Molar refractivity
126.17
Supplementary Information
InChIKey: SRLRRPYUWUTZEO-UHFFFAOYSA-N
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