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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

20896560
20896560
20896569
20896569
20896572
20896572
20896574
20896574
20896576
20896576

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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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) 2.54 9.88 -20.75 1 7 0 88 383.429 5 ↓

Analogs

20896569
20896569
20896572
20896572
20896574
20896574
20896576
20896576
20896558
20896558

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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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) 2.54 9.9 -18.9 1 7 0 88 383.429 5 ↓

Analogs

20896566
20896566

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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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) 2.96 10.54 -18.57 1 7 0 88 397.456 5 ↓

Analogs

20896563
20896563

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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) 2.96 10.54 -18.91 1 7 0 88 397.456 5 ↓

Analogs

20896572
20896572
20896574
20896574
20896576
20896576
20896558
20896558
20896560
20896560

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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) 2.98 10.52 -18.25 1 7 0 88 397.456 5 ↓

Analogs

20896574
20896574
20896576
20896576
20896558
20896558
20896560
20896560
20896569
20896569

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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) 2.98 10.54 -18.74 1 7 0 88 397.456 5 ↓

Analogs

20896576
20896576
20896558
20896558
20896560
20896560
20896569
20896569
20896572
20896572

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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) 2.59 9.24 -19 1 8 0 97 413.455 6 ↓

Analogs

20896558
20896558
20896560
20896560
20896569
20896569
20896572
20896572
20896574
20896574

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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) 2.59 9.21 -18.64 1 8 0 97 413.455 6 ↓

Analogs

20896580
20896580

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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) 2.70 9.97 -17.21 1 7 0 88 401.419 5 ↓

Analogs

20896578
20896578

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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) 2.70 9.97 -17.53 1 7 0 88 401.419 5 ↓

Analogs

20896585
20896585

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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) 3.21 10.42 -16.94 1 7 0 88 417.874 5 ↓

Analogs

20896582
20896582

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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) 3.21 10.42 -17.3 1 7 0 88 417.874 5 ↓

Analogs

20896602
20896602

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2R)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2R)-5-acetamido-3-acetyl-2H…

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) 2.31 9.93 -21.28 1 7 0 88 401.419 5 ↓

Analogs

20896599
20896599

Draw Identity 99% 90% 80% 70%

Popular Name: [3-[(2S)-5-acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl]phenyl] [3-[(2S)-5-acetamido-3-acetyl-2H…

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) 2.31 9.94 -21.7 1 7 0 88 401.419 5 ↓

Parameters Provided:

ring.id = 80196
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 = 80196 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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