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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

44685068
44685068
44685071
44685071
44685074
44685074
44685075
44685075

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-6-methoxy-N-(2-pyrrolidin-1-ylethyl)tetralin-1-amine (1S)-6-methoxy-N-(2-pyrrolidin-1…

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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) 2.02 6.27 -42.34 2 3 1 29 275.416 5 ↓
Mid Mid (pH 6-8) 2.02 7.43 -37.98 2 3 1 26 275.416 5 ↓
Lo Low (pH 4.5-6) 2.02 8.75 -125.83 3 3 2 30 276.424 5 ↓

Analogs

44685068
44685068
44685071
44685071
44685074
44685074
44685075
44685075

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-6-methoxy-N-(2-pyrrolidin-1-ylethyl)tetralin-1-amine (1R)-6-methoxy-N-(2-pyrrolidin-1…

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) 2.02 6.05 -42.8 2 3 1 29 275.416 5 ↓
Mid Mid (pH 6-8) 2.02 7.54 -38.08 2 3 1 26 275.416 5 ↓
Lo Low (pH 4.5-6) 2.02 8.59 -125.88 3 3 2 30 276.424 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-N-(2-pyrrolidin-1-ylethyl)tetralin-1-amine (1R)-N-(2-pyrrolidin-1-ylethyl)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) 1.99 6.73 -39.23 2 2 1 20 245.39 4 ↓
Mid Mid (pH 6-8) 1.99 8.22 -35.38 2 2 1 16 245.39 4 ↓
Lo Low (pH 4.5-6) 1.99 9.27 -121.09 3 2 2 21 246.398 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-N-(2-pyrrolidin-1-ylethyl)tetralin-1-amine (1S)-N-(2-pyrrolidin-1-ylethyl)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) 1.99 6.95 -38.75 2 2 1 20 245.39 4 ↓
Mid Mid (pH 6-8) 1.99 8.11 -35.19 2 2 1 16 245.39 4 ↓
Lo Low (pH 4.5-6) 1.99 9.43 -121.06 3 2 2 21 246.398 4 ↓

Parameters Provided:

ring.id = 24790
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 = 24790 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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