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

42391205
42391205
42391208
42391208

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Popular Name: (2S)-1-[(2S)-3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]-N,N-dimethyl-pyrrolidine-2-carboxamide (2S)-1-[(2S)-3-(4-aminopyrazol-1…

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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) -1.52 1.16 -38.34 4 7 1 89 282.368 5 ↓

Analogs

42391205
42391205
42391208
42391208

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Popular Name: (2R)-1-[(2S)-3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]-N,N-dimethyl-pyrrolidine-2-carboxamide (2R)-1-[(2S)-3-(4-aminopyrazol-1…

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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) -1.52 1.45 -43.58 4 7 1 89 282.368 5 ↓

Analogs

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Popular Name: [(2R)-1-[3-(3-aminopyrazol-1-yl)propyl]pyrrolidin-2-yl]methanol [(2R)-1-[3-(3-aminopyrazol-1-yl)…

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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) 0.05 2.62 -37.13 4 5 1 69 225.316 5 ↓

Analogs

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Popular Name: [(2S)-1-[3-(3-aminopyrazol-1-yl)propyl]pyrrolidin-2-yl]methanol [(2S)-1-[3-(3-aminopyrazol-1-yl)…

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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) 0.05 2.67 -37.52 4 5 1 69 225.316 5 ↓

Analogs

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Popular Name: (2S)-1-(4-aminopyrazol-1-yl)-3-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]propan-2-ol (2S)-1-(4-aminopyrazol-1-yl)-3-[…

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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) -0.67 0.2 -40.5 4 6 1 72 254.358 5 ↓
Mid Mid (pH 6-8) -0.67 2.61 -110.46 5 6 2 73 255.366 5 ↓
Mid Mid (pH 6-8) -0.67 0.18 -40.81 4 6 1 72 254.358 5 ↓

Analogs

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Popular Name: (2S)-1-(4-aminopyrazol-1-yl)-3-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]propan-2-ol (2S)-1-(4-aminopyrazol-1-yl)-3-[…

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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) -0.67 0.19 -40.82 4 6 1 72 254.358 5 ↓
Mid Mid (pH 6-8) -0.67 2.58 -110.46 5 6 2 73 255.366 5 ↓
Mid Mid (pH 6-8) -0.67 0.13 -40.18 4 6 1 72 254.358 5 ↓

Analogs

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Popular Name: (2S)-1-(4-aminopyrazol-1-yl)-3-[(3R)-3-(diethylamino)pyrrolidin-1-yl]propan-2-ol (2S)-1-(4-aminopyrazol-1-yl)-3-[…

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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 3.38 -110.89 5 6 2 73 283.42 7 ↓
Mid Mid (pH 6-8) 0.08 0.86 -37.36 4 6 1 72 282.412 7 ↓
Mid Mid (pH 6-8) 0.08 1.27 -41.56 4 6 1 72 282.412 7 ↓

Analogs

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Popular Name: (2S)-1-(4-aminopyrazol-1-yl)-3-[(3S)-3-(diethylamino)pyrrolidin-1-yl]propan-2-ol (2S)-1-(4-aminopyrazol-1-yl)-3-[…

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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 3.63 -110.97 5 6 2 73 283.42 7 ↓
Mid Mid (pH 6-8) 0.08 1.15 -37.99 4 6 1 72 282.412 7 ↓
Mid Mid (pH 6-8) 0.08 1.48 -41.05 4 6 1 72 282.412 7 ↓

Analogs

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Popular Name: 4-chloro-1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine 4-chloro-1-(3-pyrrolidin-1-ylpro…

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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) 1.30 5.72 -38.6 3 4 1 48 229.735 4 ↓

Analogs

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Popular Name: 4-methyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine 4-methyl-1-(3-pyrrolidin-1-ylpro…

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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) 1.07 5.89 -37.24 3 4 1 48 209.317 4 ↓

Analogs

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Popular Name: 1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-amine 1-(3-pyrrolidin-1-ylpropyl)pyraz…

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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) 0.50 4.2 -36.47 3 4 1 48 195.29 4 ↓

Analogs

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Popular Name: 3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-amine 3,5-dimethyl-1-(3-pyrrolidin-1-y…

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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) 0.94 5.37 -38.16 3 4 1 48 223.344 4 ↓

Analogs

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Popular Name: 1-[3-(pyrrolidin-1-yl)propyl]-1H-pyrazol-3-amine 1-[3-(pyrrolidin-1-yl)propyl]-1H…

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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) 0.70 5.21 -37.6 3 4 1 48 195.29 4 ↓

Analogs

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Popular Name: 4-bromo-1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine 4-bromo-1-(3-pyrrolidin-1-ylprop…

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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) 1.43 5.83 -38.5 3 4 1 48 274.186 4 ↓

Analogs

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Popular Name: 1-(3-pyrrolidin-1-ylpropyl)pyrazole-4-carboxylic 1-(3-pyrrolidin-1-ylpropyl)pyraz…

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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) 0.59 6.96 -69.32 1 5 0 62 223.276 5 ↓

Analogs

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Popular Name: 3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazole-4-carboxylic 3,5-dimethyl-1-(3-pyrrolidin-1-y…

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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) 1.03 7.91 -70.99 1 5 0 62 251.33 5 ↓

Analogs

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Popular Name: 2-[3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]acetic 2-[3,5-dimethyl-1-(3-pyrrolidin-…

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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) 0.89 8.66 -66.07 1 5 0 62 265.357 6 ↓

Analogs

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Popular Name: 3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazole-4-carbaldehyde 3,5-dimethyl-1-(3-pyrrolidin-1-y…

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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) 1.25 7.2 -46.92 1 4 1 39 236.339 5 ↓

Analogs

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Popular Name: [3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]methanol [3,5-dimethyl-1-(3-pyrrolidin-1-…

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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) 0.80 4.64 -40.5 2 4 1 42 238.355 5 ↓

Analogs

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Popular Name: [3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]methanamine [3,5-dimethyl-1-(3-pyrrolidin-1-…

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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) 0.65 5.36 -93.95 4 4 2 50 238.379 5 ↓
Hi High (pH 8-9.5) 0.65 4.95 -37.96 3 4 1 48 237.371 5 ↓

Analogs

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Popular Name: 1-[3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]-N-methyl-methanamine 1-[3,5-dimethyl-1-(3-pyrrolidin-…

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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) 1.02 7.23 -89.04 3 4 2 39 252.406 6 ↓
Hi High (pH 8-9.5) 1.02 5.78 -37.77 2 4 1 34 251.398 6 ↓

Analogs

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Popular Name: N-[[3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]methyl]ethanamine N-[[3,5-dimethyl-1-(3-pyrrolidin…

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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) 1.40 8.14 -88.94 3 4 2 39 266.433 7 ↓
Hi High (pH 8-9.5) 1.40 6.77 -37.7 2 4 1 34 265.425 7 ↓

Analogs

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Popular Name: N-[[3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]methyl]propan-1-amine N-[[3,5-dimethyl-1-(3-pyrrolidin…

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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) 1.90 8.89 -90.12 3 4 2 39 280.46 8 ↓
Hi High (pH 8-9.5) 1.90 7.53 -37.65 2 4 1 34 279.452 8 ↓

Analogs

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Popular Name: N-[[3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]methyl]propan-2-amine N-[[3,5-dimethyl-1-(3-pyrrolidin…

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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) 1.69 8.61 -87.13 3 4 2 39 280.46 7 ↓
Hi High (pH 8-9.5) 1.69 7.39 -37.35 2 4 1 34 279.452 7 ↓

Analogs

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Popular Name: 4-bromo-1-(3-pyrrolidin-1-ylpropyl)pyrazole 4-bromo-1-(3-pyrrolidin-1-ylprop…

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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) 1.83 6.94 -38.08 1 3 1 22 259.171 4 ↓

Analogs

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Popular Name: 4-bromo-3-nitro-1-(3-pyrrolidin-1-ylpropyl)pyrazole 4-bromo-3-nitro-1-(3-pyrrolidin-…

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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) 1.91 8.59 -48.35 1 6 1 68 304.168 5 ↓

Parameters Provided:

ring.id = 62327
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 = 62327 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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