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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: (1R)-N-(cyclopropylmethyl)-N-ethyl-1-(2-naphthyl)ethane-1,2-diamine (1R)-N-(cyclopropylmethyl)-N-eth…

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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) 3.16 6.74 -46.21 3 2 1 31 269.412 6 ↓
Mid Mid (pH 6-8) 3.16 9.05 -129.17 4 2 2 32 270.42 6 ↓

Analogs

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Popular Name: (1S)-N-(cyclopropylmethyl)-N-ethyl-1-(2-naphthyl)ethane-1,2-diamine (1S)-N-(cyclopropylmethyl)-N-eth…

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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) 3.16 7.16 -46.33 3 2 1 31 269.412 6 ↓
Mid Mid (pH 6-8) 3.16 9.05 -130.08 4 2 2 32 270.42 6 ↓

Analogs

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Popular Name: 3-[[cyclopropylmethyl(ethyl)amino]methyl]naphthalen-2-amine 3-[[cyclopropylmethyl(ethyl)amin…

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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) 3.58 9.64 -36.45 3 2 1 30 255.385 5 ↓

Analogs

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Popular Name: (2S)-2-(cyclopropylmethylamino)-2-(2-naphthyl)propan-1-ol (2S)-2-(cyclopropylmethylamino)-…

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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) 3.55 6.94 -36.82 3 2 1 37 256.369 5 ↓

Analogs

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Popular Name: (2R)-2-(cyclopropylmethylamino)-2-(2-naphthyl)propan-1-ol (2R)-2-(cyclopropylmethylamino)-…

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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) 3.55 6.93 -36.94 3 2 1 37 256.369 5 ↓

Analogs

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Popular Name: (2S)-2-(cyclopropylmethylamino)-2-(6-methoxy-2-naphthyl)propan-1-ol (2S)-2-(cyclopropylmethylamino)-…

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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) 3.58 6.24 -39.35 3 3 1 46 286.395 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(cyclopropylmethylamino)-2-(6-methoxy-2-naphthyl)propan-1-ol (2R)-2-(cyclopropylmethylamino)-…

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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) 3.58 6.22 -39.52 3 3 1 46 286.395 6 ↓

Analogs

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Popular Name: (2S)-2-(cyclopropylmethylamino)-2-(2-naphthyl)ethanol (2S)-2-(cyclopropylmethylamino)-…

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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) 3.10 6.6 -39.52 3 2 1 37 242.342 5 ↓

Analogs

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Popular Name: (2R)-2-(cyclopropylmethylamino)-2-(2-naphthyl)ethanol (2R)-2-(cyclopropylmethylamino)-…

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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) 3.10 6.61 -39.44 3 2 1 37 242.342 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-(cyclopropylmethylamino)-2-(6-methoxy-2-naphthyl)ethanol (2S)-2-(cyclopropylmethylamino)-…

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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) 3.13 5.9 -42.57 3 3 1 46 272.368 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(cyclopropylmethylamino)-2-(6-methoxy-2-naphthyl)ethanol (2R)-2-(cyclopropylmethylamino)-…

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) 3.13 5.9 -42.4 3 3 1 46 272.368 6 ↓

Parameters Provided:

ring.id = 324941
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 = 324941 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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