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

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopropylmethyl-[[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoyl]amino]acetic 2-[cyclopropylmethyl-[[(4R)-4,5,…

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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) 0.84 9.2 -48.16 1 5 -1 72 307.395 5 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoyl]amino]acetic 2-[cyclopropylmethyl-[[(4S)-4,5,…

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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) 0.84 8.82 -46.92 1 5 -1 72 307.395 5 ↓

Analogs

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Popular Name: (2S)-2-cyclopropyl-2-[[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]acetic (2S)-2-cyclopropyl-2-[[(4R)-4,5,…

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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) -0.52 6.31 -58.57 2 5 -1 81 293.368 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-cyclopropyl-2-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]acetic (2S)-2-cyclopropyl-2-[[(4S)-4,5,…

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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) -0.52 5.95 -56.52 2 5 -1 81 293.368 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-cyclopropyl-2-[[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]acetic (2R)-2-cyclopropyl-2-[[(4R)-4,5,…

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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) -0.52 6.36 -57.61 2 5 -1 81 293.368 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-cyclopropyl-2-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]acetic (2R)-2-cyclopropyl-2-[[(4S)-4,5,…

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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) -0.52 5.97 -61.46 2 5 -1 81 293.368 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-cyclopropyl-2-[[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]propanoic (2R)-2-cyclopropyl-2-[[(4R)-4,5,…

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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 6.91 -58.9 2 5 -1 81 307.395 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-cyclopropyl-2-[[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]propanoic (2S)-2-cyclopropyl-2-[[(4R)-4,5,…

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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 6.91 -60.76 2 5 -1 81 307.395 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-cyclopropyl-2-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]propanoic (2R)-2-cyclopropyl-2-[[(4S)-4,5,…

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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 6.46 -60.7 2 5 -1 81 307.395 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-cyclopropyl-2-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoylamino]propanoic (2S)-2-cyclopropyl-2-[[(4S)-4,5,…

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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 6.53 -59.5 2 5 -1 81 307.395 4 ↓

Parameters Provided:

ring.id = 212459
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 = 212459 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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