UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

7501884
7501884

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Popular Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl (4,6-diamino-1,3,5-triazin-2-yl)…

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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) 1.22 -2.63 -13.15 4 9 0 135 345.359 8 ↓

Analogs

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Popular Name: (4-amino-6-dimethylamino-1,3,5-triazin-2-yl)methyl (4-amino-6-dimethylamino-1,3,5-t…

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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) 2.56 -0.33 -12.42 2 8 0 103 343.387 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-amino-6-dimethylamino-1,3,5-triazin-2-yl)methyl (4-amino-6-dimethylamino-1,3,5-t…

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) 1.79 1 -19.54 2 10 0 137 384.396 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-amino-6-dimethylamino-1,3,5-triazin-2-yl)methyl (4-amino-6-dimethylamino-1,3,5-t…

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) 2.29 0.16 -12.29 2 7 0 94 317.324 6 ↓

Parameters Provided:

ring.id = 5112
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 = 5112 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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