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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: 2-chloro-4-methoxy-6-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2-chloro-4-methoxy-6-[(3S)-3-(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) 3.10 6.92 -41.17 1 6 1 56 298.798 3 ↓
Hi High (pH 8-9.5) 3.10 4.51 -5.24 0 6 0 54 297.79 3 ↓

Analogs

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Popular Name: 2-chloro-4-methoxy-6-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2-chloro-4-methoxy-6-[(3R)-3-(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) 3.10 6.94 -41.14 1 6 1 56 298.798 3 ↓
Hi High (pH 8-9.5) 3.10 4.79 -5.56 0 6 0 54 297.79 3 ↓

Analogs

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Popular Name: 2-chloro-4-ethoxy-6-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2-chloro-4-ethoxy-6-[(3S)-3-(1-p…

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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) 3.48 7.85 -40.94 1 6 1 56 312.825 4 ↓
Hi High (pH 8-9.5) 3.48 5.44 -5 0 6 0 54 311.817 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-4-ethoxy-6-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2-chloro-4-ethoxy-6-[(3R)-3-(1-p…

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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) 3.48 7.87 -40.86 1 6 1 56 312.825 4 ↓
Hi High (pH 8-9.5) 3.48 5.72 -5.34 0 6 0 54 311.817 4 ↓

Analogs

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Popular Name: 2,4-dichloro-6-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2,4-dichloro-6-[(3R)-3-(1-piperi…

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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) 3.32 10.03 -40.75 1 5 1 46 303.217 2 ↓
Hi High (pH 8-9.5) 3.32 7.87 -3.4 0 5 0 45 302.209 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4-dichloro-6-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2,4-dichloro-6-[(3S)-3-(1-piperi…

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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) 3.32 10.05 -40.77 1 5 1 46 303.217 2 ↓
Hi High (pH 8-9.5) 3.32 7.9 -3.78 0 5 0 45 302.209 2 ↓

Analogs

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Popular Name: 4-chloro-N,N-dimethyl-6-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazin-2-amine 4-chloro-N,N-dimethyl-6-[(3S)-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) 3.28 12.62 -40.65 1 6 1 50 311.841 3 ↓
Hi High (pH 8-9.5) 3.28 10.21 -6.62 0 6 0 48 310.833 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N,N-dimethyl-6-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazin-2-amine 4-chloro-N,N-dimethyl-6-[(3R)-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) 3.28 12.64 -40.65 1 6 1 50 311.841 3 ↓
Hi High (pH 8-9.5) 3.28 10.49 -7 0 6 0 48 310.833 3 ↓

Parameters Provided:

ring.id = 327085
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 = 327085 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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