UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12233807
12233807

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Popular Name: 4-oxo-8-phenyl-N-(3-phenylpropyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-8-phenyl-N-(3-phenylpropyl…

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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) 2.95 0.27 -18 1 7 0 80 375.432 6 ↓

Analogs

12233606
12233606

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Popular Name: 4-oxo-N-(3-phenylpropyl)-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-N-(3-phenylpropyl)-8-(p-to…

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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) 3.40 0.59 -17.94 1 7 0 80 389.459 6 ↓

Analogs

12233812
12233812

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Popular Name: N-[(1S)-1-methyl-3-phenyl-propyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo N-[(1S)-1-methyl-3-phenyl-propyl…

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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) 3.73 1.39 -17.81 1 7 0 80 403.486 6 ↓

Analogs

12233809
12233809

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Popular Name: N-[(1R)-1-methyl-3-phenyl-propyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo N-[(1R)-1-methyl-3-phenyl-propyl…

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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) 3.73 1.39 -17.77 1 7 0 80 403.486 6 ↓

Analogs

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Popular Name: 8-(4-methoxyphenyl)-4-oxo-N-(3-phenylpropyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 8-(4-methoxyphenyl)-4-oxo-N-(3-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) 3.00 0.28 -19.72 1 8 0 89 405.458 7 ↓

Analogs

12233980
12233980
12234163
12234163
12234166
12234166

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Popular Name: 8-(4-methoxyphenyl)-N-[(1S)-1-methyl-3-phenyl-propyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine 8-(4-methoxyphenyl)-N-[(1S)-1-me…

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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) 3.33 1.08 -19.51 1 8 0 89 419.485 7 ↓

Analogs

12234163
12234163
12234166
12234166
12233977
12233977

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Popular Name: 8-(4-methoxyphenyl)-N-[(1R)-1-methyl-3-phenyl-propyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine 8-(4-methoxyphenyl)-N-[(1R)-1-me…

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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) 3.33 1.08 -19.5 1 8 0 89 419.485 7 ↓

Analogs

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Popular Name: 8-(4-ethoxyphenyl)-4-oxo-N-(3-phenylpropyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 8-(4-ethoxyphenyl)-4-oxo-N-(3-ph…

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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) 3.38 0.29 -19.55 1 8 0 89 419.485 8 ↓

Analogs

12234166
12234166
12233977
12233977
12233980
12233980

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Popular Name: 8-(4-ethoxyphenyl)-N-[(1S)-1-methyl-3-phenyl-propyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine- 8-(4-ethoxyphenyl)-N-[(1S)-1-met…

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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) 3.71 1.09 -19.32 1 8 0 89 433.512 8 ↓

Analogs

12233977
12233977
12233980
12233980
12234163
12234163

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Popular Name: 8-(4-ethoxyphenyl)-N-[(1R)-1-methyl-3-phenyl-propyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine- 8-(4-ethoxyphenyl)-N-[(1R)-1-met…

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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) 3.71 1.09 -19.31 1 8 0 89 433.512 8 ↓

Analogs

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Popular Name: 8-(4-fluorophenyl)-4-oxo-N-(3-phenylpropyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 8-(4-fluorophenyl)-4-oxo-N-(3-ph…

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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) 3.11 1 -19.02 1 7 0 80 393.422 6 ↓

Analogs

12234327
12234327

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Popular Name: 8-(4-fluorophenyl)-N-[(1S)-1-methyl-3-phenyl-propyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine- 8-(4-fluorophenyl)-N-[(1S)-1-met…

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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) 3.44 1.81 -18.82 1 7 0 80 407.449 6 ↓

Analogs

12234326
12234326

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Popular Name: 8-(4-fluorophenyl)-N-[(1R)-1-methyl-3-phenyl-propyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine- 8-(4-fluorophenyl)-N-[(1R)-1-met…

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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) 3.44 1.81 -18.8 1 7 0 80 407.449 6 ↓

Parameters Provided:

ring.id = 97796
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 = 97796 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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