UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 7-amino-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]-1H-indole-2-carboxamide 7-amino-N-[(1S)-1-(2H-tetrazol-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) 0.40 -0.22 -36.94 4 8 -1 124 270.276 3 ↓
Lo Low (pH 4.5-6) 0.40 -0.22 -9.54 5 8 0 125 271.284 3 ↓

Analogs

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Popular Name: 7-amino-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]-1H-indole-2-carboxamide 7-amino-N-[(1R)-1-(2H-tetrazol-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) 0.40 -0.21 -36.89 4 8 -1 124 270.276 3 ↓
Lo Low (pH 4.5-6) 0.40 -0.22 -9.57 5 8 0 125 271.284 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-amino-N-(1H-tetrazol-5-ylmethyl)-1H-indole-2-carboxamide 7-amino-N-(1H-tetrazol-5-ylmethy…

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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) -0.16 -0.91 -36.37 4 8 -1 124 256.249 3 ↓

Analogs

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Popular Name: 5-amino-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]-1H-indole-2-carboxamide 5-amino-N-[(1S)-1-(2H-tetrazol-5…

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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) 0.02 -0.24 -37.87 4 8 -1 124 270.276 3 ↓
Lo Low (pH 4.5-6) 0.02 -0.24 -9.97 5 8 0 125 271.284 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]-1H-indole-2-carboxamide 5-amino-N-[(1R)-1-(2H-tetrazol-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) 0.02 -0.24 -37.88 4 8 -1 124 270.276 3 ↓
Lo Low (pH 4.5-6) 0.02 -0.24 -9.96 5 8 0 125 271.284 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-(1H-tetrazol-5-ylmethyl)-1H-indole-2-carboxamide 5-amino-N-(1H-tetrazol-5-ylmethy…

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) -0.54 -0.94 -37.36 4 8 -1 124 256.249 3 ↓

Parameters Provided:

ring.id = 285272
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 = 285272 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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