Ki Summary

Reaction Details

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Target

Aquaporin-1

Ligand

BDBM178094

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2271917

IC50

29400±n/a nM

Citation

Titko, T; Perekhoda, L; Drapak, I; Tsapko, Y Modern trends in diuretics development. Eur J Med Chem208:0 (2020) [PubMed]

More Info.:

Get all data from this article, Assay Method

Aquaporin-1

Name:

Aquaporin-1

Synonyms:

AQP1 | AQP1_HUMAN | Aquaporin-1 (AQP1) | CHIP28

Type:

Protein

Mol. Mass.:

28528.18

Organism:

Homo sapiens (Human)

Description:

n/a

Residue:

269

Sequence:

MASEFKKKLFWRAVVAEFLATTLFVFISIGSALGFKYPVGNNQTAVQDNVKVSLAFGLSI
ATLAQSVGHISGAHLNPAVTLGLLLSCQISIFRALMYIIAQCVGAIVATAILSGITSSLT
GNSLGRNDLADGVNSGQGLGIEIIGTLQLVLCVLATTDRRRRDLGGSAPLAIGLSVALGH
LLAIDYTGCGINPARSFGSAVITHNFSNHWIFWVGPFIGGALAVLIYDFILAPRSSDLTD
RVKVWTSGQVEEYDLDADDINSRVEMKPK

BDBM178094

n/a

Name

BDBM178094

Synonyms:

{[7-(2,6-dichlorophenyl)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl}(methyl)amine (Compound 6)

Type

Small organic molecule

Emp. Form.

C16H14Cl2FNO

Mol. Mass.

326.193

SMILES

CNCC1Cc2cc(F)cc(c2O1)-c1c(Cl)cccc1Cl |(12.06,10.63,;10.52,10.63,;9.75,9.29,;8.21,9.29,;7.31,10.54,;5.84,10.07,;4.51,10.84,;3.18,10.07,;1.84,10.84,;3.18,8.53,;4.51,7.75,;5.84,8.53,;7.31,8.05,;4.51,6.21,;3.18,5.44,;1.84,6.21,;3.18,3.9,;4.51,3.13,;5.84,3.9,;5.84,5.44,;7.18,6.21,)|

Structure