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Analogs

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Popular Name: (9R)-2-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-amine (9R)-2-phenyl-6,7,8,9-tetrahydro…

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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) 2.48 8.58 -43.63 3 1 1 28 238.354 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (9S)-2-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-amine (9S)-2-phenyl-6,7,8,9-tetrahydro…

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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) 2.48 8.58 -43.61 3 1 1 28 238.354 1 ↓

Analogs

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Popular Name: (9R)-N-methyl-2-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-amine (9R)-N-methyl-2-phenyl-6,7,8,9-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) 3.84 10.61 -37.77 2 1 1 17 252.381 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (9S)-N-methyl-2-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-amine (9S)-N-methyl-2-phenyl-6,7,8,9-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) 3.84 9.79 -42.59 2 1 1 17 252.381 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (9R)-2-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-ol (9R)-2-phenyl-6,7,8,9-tetrahydro…

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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) 4.18 8.08 -3.93 1 1 0 20 238.33 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (9S)-2-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-ol (9S)-2-phenyl-6,7,8,9-tetrahydro…

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) 4.18 7.73 -4.81 1 1 0 20 238.33 1 ↓

Parameters Provided:

ring.id = 151535
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 = 151535 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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