UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (2S)-N-[(1R)-indan-1-yl]-N-methyl-pyrrolidine-2-carboxamide (2S)-N-[(1R)-indan-1-yl]-N-methy…

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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) 1.68 6.65 -37.16 2 3 1 37 245.346 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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) 1.68 6.7 -38.23 2 3 1 37 245.346 2 ↓

Analogs

37817288
37817288
37817289
37817289
37817290
37817290
37817291
37817291

Draw Identity 99% 90% 80% 70%

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

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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) 1.68 6.59 -37.15 2 3 1 37 245.346 2 ↓

Analogs

37817288
37817288
37817289
37817289
37817290
37817290
37817291
37817291

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-indan-1-yl]-N-methyl-pyrrolidine-2-carboxamide (2R)-N-[(1S)-indan-1-yl]-N-methy…

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) 1.68 6.67 -37.33 2 3 1 37 245.346 2 ↓

Analogs

37817336
37817336
37817337
37817337
37817338
37817338
37817339
37817339

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Popular Name: (2S,4S)-4-hydroxy-N-[(1R)-indan-1-yl]-N-methyl-pyrrolidine-2-carboxamide (2S,4S)-4-hydroxy-N-[(1R)-indan-…

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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) 0.77 3.21 -41.17 3 4 1 57 261.345 2 ↓

Analogs

37817336
37817336
37817337
37817337
37817338
37817338
37817339
37817339

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-4-hydroxy-N-[(1S)-indan-1-yl]-N-methyl-pyrrolidine-2-carboxamide (2S,4S)-4-hydroxy-N-[(1S)-indan-…

Find On: PubMed — Wikipedia — Google

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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) 0.77 3.3 -42.31 3 4 1 57 261.345 2 ↓

Analogs

37817336
37817336
37817337
37817337
37817338
37817338
37817339
37817339

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-4-hydroxy-N-[(1R)-indan-1-yl]-N-methyl-pyrrolidine-2-carboxamide (2R,4S)-4-hydroxy-N-[(1R)-indan-…

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) 0.77 3.3 -39.85 3 4 1 57 261.345 2 ↓

Analogs

37817336
37817336
37817337
37817337
37817338
37817338
37817339
37817339

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-4-hydroxy-N-[(1S)-indan-1-yl]-N-methyl-pyrrolidine-2-carboxamide (2R,4S)-4-hydroxy-N-[(1S)-indan-…

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) 0.77 3.39 -39.71 3 4 1 57 261.345 2 ↓

Analogs

40476157
40476157
40476160
40476160
40476163
40476163
40476165
40476165
27082629
27082629

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-4-hydroxy-N-[(1S)-indan-1-yl]pyrrolidine-2-carboxamide (2S,4S)-4-hydroxy-N-[(1S)-indan-…

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) 0.52 1.67 -43.5 4 4 1 66 247.318 2 ↓

Analogs

40476157
40476157
40476160
40476160
40476163
40476163
40476165
40476165
27082629
27082629

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S)-4-hydroxy-N-[(1R)-indan-1-yl]pyrrolidine-2-carboxamide (2S,4S)-4-hydroxy-N-[(1R)-indan-…

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) 0.52 1.62 -42.73 4 4 1 66 247.318 2 ↓

Analogs

40476157
40476157
40476160
40476160
40476163
40476163
40476165
40476165
27082629
27082629

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-4-hydroxy-N-[(1S)-indan-1-yl]pyrrolidine-2-carboxamide (2R,4S)-4-hydroxy-N-[(1S)-indan-…

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) 0.52 1.67 -39.56 4 4 1 66 247.318 2 ↓

Analogs

40476157
40476157
40476160
40476160
40476163
40476163
40476165
40476165
27082629
27082629

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4S)-4-hydroxy-N-[(1R)-indan-1-yl]pyrrolidine-2-carboxamide (2R,4S)-4-hydroxy-N-[(1R)-indan-…

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) 0.52 1.61 -40.77 4 4 1 66 247.318 2 ↓

Parameters Provided:

ring.id = 65914
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 = 65914 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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