Vk-0214
[4-[(3-benzyl-4-hydroxyphenyl)methyl]-3,5-dimethylphenoxy]methylphosphonic acid
Molecular Identity
Vk-0214
[4-[(3-benzyl-4-hydroxyphenyl)methyl]-3,5-dimethylphenoxy]methylphosphonic acid
PubChem CID: 15942270
2D Structure
Properties
C23H25O5P
Molecular Formula
412.40
Molecular Weight
g/mol
412.1440
Exact Mass
Da
4.4
XLogP
Drug-like (Lipinski: < 5)
87
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
5
H-Bond Acceptors
531
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)CC3=CC=CC=C3)C)OCP(=O)(O)OIsomeric SMILES
SMILES: CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)CC3=CC=CC=C3)C)OCP(=O)(O)OSynonyms(17)
VK-0214852949-30-56FGG71NJ3YVK0214UNII-6FGG71NJ3Y((4-(3-Benzyl-4-hydroxybenzyl)-3,5-dimethylphenoxy)methyl)phosphonic acid(((4-(3-Benzyl-4-hydroxybenzyl)-3,5-dimethylphenyl)oxy)methyl)phosphonic acidPhosphonic acid, P-((4-((4-hydroxy-3-(phenylmethyl)phenyl)methyl)-3,5-dimethylphenoxy)methyl)-RefChem:194584UNII-BYT6883X9XSCHEMBL283442orb2564566CHEMBL4802139EX-A12324HY-156679
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Vk-0214
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