UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-[(3-fluorophenyl)methyl]cyclopropanamine N-[(1-benzylpyrrol-2-yl)methyl]-…

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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) 4.46 14.4 -44.08 1 2 1 9 335.446 7 ↓

Analogs

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Popular Name: N-(p-tolylmethyl)-N-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]cyclopropanamine N-(p-tolylmethyl)-N-[[1-(p-tolyl…

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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) 5.22 15.85 -35.68 1 2 1 9 345.51 7 ↓

Analogs

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Popular Name: N-(o-tolylmethyl)-N-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]cyclopropanamine N-(o-tolylmethyl)-N-[[1-(p-tolyl…

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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) 5.17 15.83 -32.65 1 2 1 9 345.51 7 ↓

Analogs

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Popular Name: N-[(3-fluorophenyl)methyl]-N-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]cyclopropanamine N-[(3-fluorophenyl)methyl]-N-[[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) 4.91 15.23 -40.35 1 2 1 9 349.473 7 ↓

Analogs

35841121
35841121
4572501
4572501

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Popular Name: N-[(3-methoxyphenyl)methyl]-N-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]cyclopropanamine N-[(3-methoxyphenyl)methyl]-N-[[…

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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) 4.80 14.46 -37.7 1 3 1 19 361.509 8 ↓

Analogs

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Popular Name: N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-N-(p-tolylmethyl)cyclopropanamine N-[[1-(o-tolylmethyl)pyrrol-2-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) 5.17 15.42 -35.58 1 2 1 9 345.51 7 ↓

Analogs

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Popular Name: N-[(4-methoxyphenyl)methyl]-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]cyclopropanamine N-[(4-methoxyphenyl)methyl]-N-[[…

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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) 4.78 14.04 -38.39 1 3 1 19 361.509 8 ↓

Analogs

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Popular Name: 3-[[cyclopropyl-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]amino]methyl]benzonitrile 3-[[cyclopropyl-[[1-(o-tolylmeth…

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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) 4.45 15.12 -46.49 1 3 1 33 356.493 7 ↓

Analogs

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Popular Name: N-[(4-methoxyphenyl)methyl]-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]cyclopropanamine N-[(4-methoxyphenyl)methyl]-N-[[…

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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) 4.41 12.91 -45.28 1 4 1 28 377.508 9 ↓

Analogs

35841121
35841121
4917628
4917628
4572501
4572501

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Popular Name: N-[(3-methoxyphenyl)methyl]-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]cyclopropanamine N-[(3-methoxyphenyl)methyl]-N-[[…

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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) 4.39 12.91 -38.56 1 4 1 28 377.508 9 ↓

Analogs

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Popular Name: 3-[[cyclopropyl-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]amino]methyl]benzonitrile 3-[[cyclopropyl-[[1-[[3-(trifluo…

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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) 4.92 15.7 -50.08 1 3 1 33 410.463 8 ↓

Analogs

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Popular Name: N-[(2-fluorophenyl)methyl]-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]cyclopropanamine N-[(2-fluorophenyl)methyl]-N-[[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) 4.47 13.19 -34.69 1 3 1 19 365.472 8 ↓

Parameters Provided:

ring.id = 17934
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 = 17934 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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