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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: (3S)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-3-methyl-pyrrolidine-3-carboxylic (3S)-1-[(1-cyclopropyltetrazol-5…

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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) -0.42 6.18 -53.76 1 7 0 88 251.29 4 ↓
Hi High (pH 8-9.5) -0.42 3.75 -48.81 0 7 -1 87 250.282 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-3-methyl-pyrrolidine-3-carboxylic (3R)-1-[(1-cyclopropyltetrazol-5…

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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) -0.42 6.17 -56.29 1 7 0 88 251.29 4 ↓
Hi High (pH 8-9.5) -0.42 3.68 -47.74 0 7 -1 87 250.282 4 ↓

Analogs

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Popular Name: (3S)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-3-ethyl-pyrrolidine-3-carboxylic (3S)-1-[(1-cyclopropyltetrazol-5…

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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) -0.08 6.72 -55.57 1 7 0 88 265.317 5 ↓
Hi High (pH 8-9.5) -0.08 4.03 -41.46 0 7 -1 87 264.309 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-3-ethyl-pyrrolidine-3-carboxylic (3R)-1-[(1-cyclopropyltetrazol-5…

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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) -0.08 6.65 -55.15 1 7 0 88 265.317 5 ↓
Hi High (pH 8-9.5) -0.08 4.15 -46.63 0 7 -1 87 264.309 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-3-propyl-pyrrolidine-3-carboxylic (3S)-1-[(1-cyclopropyltetrazol-5…

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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) 0.48 7.47 -49.29 1 7 0 88 279.344 6 ↓
Hi High (pH 8-9.5) 0.48 4.97 -49.01 0 7 -1 87 278.336 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-3-propyl-pyrrolidine-3-carboxylic (3R)-1-[(1-cyclopropyltetrazol-5…

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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) 0.48 7.41 -55.22 1 7 0 88 279.344 6 ↓
Hi High (pH 8-9.5) 0.48 4.91 -47.04 0 7 -1 87 278.336 6 ↓

Analogs

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Popular Name: (2R)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide (2R)-1-[(1-cyclopropyltetrazol-5…

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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) 0.01 4.81 -44.69 2 7 1 77 319.311 6 ↓
Mid Mid (pH 6-8) 0.01 2.61 -11.79 1 7 0 76 318.303 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide (2S)-1-[(1-cyclopropyltetrazol-5…

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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) 0.01 4.74 -45.56 2 7 1 77 319.311 6 ↓
Mid Mid (pH 6-8) 0.01 2.82 -12.36 1 7 0 76 318.303 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-N-methyl-pyrrolidine-2-carboxamide (2S)-1-[(1-cyclopropyltetrazol-5…

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) -0.91 3.5 -41.09 2 7 1 77 251.314 4 ↓
Hi High (pH 8-9.5) -0.91 1.39 -12.5 1 7 0 76 250.306 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[(1-cyclopropyltetrazol-5-yl)methyl]-N-methyl-pyrrolidine-2-carboxamide (2R)-1-[(1-cyclopropyltetrazol-5…

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) -0.91 3.49 -45.46 2 7 1 77 251.314 4 ↓
Hi High (pH 8-9.5) -0.91 1.63 -15.56 1 7 0 76 250.306 4 ↓

Parameters Provided:

ring.id = 9502
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 = 9502 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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