Molecular Identity
3-(2-Carboxypiperazin-4-yl)propyl-1-phosphonic acid
4-(3-phosphonopropyl)piperazine-2-carboxylic acid
PubChem CID: 1228
2D Structure
Properties
C8H17N2O5P
Molecular Formula
252.20
Molecular Weight
g/mol
252.0875
Exact Mass
Da
-6.8
XLogP
Drug-like (Lipinski: < 5)
110
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
7
H-Bond Acceptors
292
Complexity
SMILES
Canonical SMILES
SMILES: C1CN(CC(N1)C(=O)O)CCCP(=O)(O)OIsomeric SMILES
SMILES: C1CN(CC(N1)C(=O)O)CCCP(=O)(O)OSynonyms(20)
100828-16-83-2-Cpp3-(2-Carboxypiperazin-4-yl)propyl-1-phosphonic acid2-Piperazinecarboxylic acid, 4-(3-phosphonopropyl)-4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid98Y1I8ZD4MRefChem:490762634-473-54-(3-phosphonopropyl)piperazine-2-carboxylic acid(RS)-CPPCARBOXYPEPTIDASE P9075-64-3(+/-)-CPPCHEMBL22304C8H17N2O5P
Data from PubChem (NCBI)
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Molecular Structure
3-(2-Carboxypiperazin-4-yl)propyl-1-phosphonic acid
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Drug Network
Trials and conditions connected to 3-(2-Carboxypiperazin-4-yl)propyl-1-phosphonic acid
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