UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

19850653
19850653

Draw Identity 99% 90% 80% 70%

Popular Name: Benzenephosphonic acid Benzenephosphonic acid

Find On: PubMed — Wikipedia — Google

Vendors

And 16 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
CAH2-7-E Carbonic Anhydrase II (cluster #7 Of 15), Eukaryotic Eukaryotes 99 0.98 Binding ≤ 10μM
CAH4-8-E Carbonic Anhydrase IV (cluster #8 Of 16), Eukaryotic Eukaryotes 5400 0.74 Binding ≤ 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) 0.75 2.76 -133.29 0 3 -2 63 156.077 1 ↓
Mid Mid (pH 6-8) 0.75 1.65 -44.12 1 3 -1 60 157.085 1 ↓

Parameters Provided:

target.name = CAH2-7-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 'CAH2-7-E' AND t.atype_fk = 0 AND c.purchasable IN (1,2,4,5)    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?target.name=CAH2-7-E&target.type=B10&filter.purchasability=purchasable

Embed Link to Results