UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

1251396
1251396
9233680
9233680

Draw Identity 99% 90% 80% 70%

Popular Name: (5Z)-1-(2-furylmethyl)-5-[(1-piperidylamino)methylene]hexahydropyrimidine-2,4,6-trione (5Z)-1-(2-furylmethyl)-5-[(1-pip…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.76 1.42 -47.86 1 8 -1 103 317.325 4 ↓
Mid Mid (pH 6-8) 0.30 4.06 -8.67 2 8 0 100 318.333 4 ↓

Parameters Provided:

ring.id = 57541
filter.purchasability = annotated
page.format = targets
page.num = 1

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 hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 57541 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=57541&filter.purchasability=annotated

Embed Link to Results