General Information of the Compound
Compound ID
CP0377001
Compound Name
(2S)-2-Amino-5-[(hydroxy)phosphinyl]pentanoic Acid
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Formula
C5H12NO4P
Molecular Weight
181.128
Canonical SMILES
N[C@@H](CCCP(O)=O)C(O)=O
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InChI
InChI=1S/C5H12NO4P/c6-4(5(7)8)2-1-3-11(9)10/h4,11H,1-3,6H2,(H,7,8)(H,9,10)/t4-/m0/s1
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InChIKey
ZHJOHIXDEYEIAU-BYPYZUCNSA-N
Physicochemical Property
logP
-0.3545
Rotatable Bonds
5
Heavy Atom Count
11
Polar Areas
100.62
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
3
Complexity
11

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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ChEMBL ID
CHEMBL1089174
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04980, Metabotropic glutamate receptor 8
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
EC50 = 73000 nM
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