UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

4262273
4262273
33799859
33799859
33799860
33799860
41659903
41659903
41659908
41659908

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Popular Name: DL-2-Aminotetralin-2-carboxylic acid DL-2-Aminotetralin-2-carboxylic …

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Vendors

And 24 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
LAT1-1-E L-type Amino Acid Transporter 1 (cluster #1 Of 1), Eukaryotic Eukaryotes 7700 0.51 Binding ≤ 10μM
Z80193-2-O L1210 (Lymphocytic Leukemia Cells) (cluster #2 Of 12), Other Other 5000 0.53 Functional ≤ 10μM

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.64 3.99 -34.91 3 3 0 68 191.23 1 ↓

Analogs

33799859
33799859
33799860
33799860
41659903
41659903
41659908
41659908
41731356
41731356

Draw Identity 99% 90% 80% 70%

Popular Name: DL-2-Aminotetralin-2-carboxylic acid DL-2-Aminotetralin-2-carboxylic …

Find On: PubMed — Wikipedia — Google

Vendors

And 25 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
LAT1-1-E L-type Amino Acid Transporter 1 (cluster #1 Of 1), Eukaryotic Eukaryotes 7700 0.51 Binding ≤ 10μM
Z80193-2-O L1210 (Lymphocytic Leukemia Cells) (cluster #2 Of 12), Other Other 5000 0.53 Functional ≤ 10μM

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.64 3.98 -34.68 3 3 0 68 191.23 1 ↓

Parameters Provided:

target.name = LAT1-1-E
target.type = B10
page.format = summary
page.num = 1
filter.purchasability = purchasable

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN activity AS ac ON ci.sub_id_fk=ac.sub_id_fk INNER JOIN target AS t ON ac.target_fk=t.target_id  WHERE c.free = 1 AND t.code LIKE 'LAT1-1-E' AND t.atype_fk = 0 AND c.purchasable IN (1,2,4,5)    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?target.name=LAT1-1-E&target.type=B10&filter.purchasability=purchasable

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