UCSF
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Analogs

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Popular Name: (2S)-2-[(ketoBLAHcarbonyl)amino]-3-phenyl-propionate (2S)-2-[(ketoBLAHcarbonyl)amino]…

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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) 0.65 -1.1 -81.36 1 7 -1 94 380.424 4 ↓

Analogs

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Popular Name: N-[(1S)-1-benzyl-2-(isobutylamino)-2-keto-ethyl]-keto-BLAHcarboxamide N-[(1S)-1-benzyl-2-(isobutylamin…

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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) 3.09 -1.98 -28.09 2 7 0 83 436.556 6 ↓

Analogs

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Popular Name: N-[(1S)-1-benzyl-2-hydrazino-2-keto-ethyl]-keto-BLAHcarboxamide N-[(1S)-1-benzyl-2-hydrazino-2-k…

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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) 0.51 -6.81 -29.23 4 8 0 109 395.463 4 ↓

Analogs

2149273
2149273

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Popular Name: N-[(1S)-1-benzyl-2-keto-2-[[(1R)-1-methylpropyl]amino]ethyl]-keto-BLAHcarboxamide N-[(1S)-1-benzyl-2-keto-2-[[(1R)…

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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) 3.17 -1.38 -28.57 2 7 0 83 436.556 6 ↓

Analogs

2149273
2149273

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Popular Name: N-[(1S)-1-benzyl-2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl]-keto-BLAHcarboxamide N-[(1S)-1-benzyl-2-keto-2-[[(1S)…

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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) 3.17 -1.61 -24.98 2 7 0 83 436.556 6 ↓

Analogs

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Popular Name: N-[(1S)-1-benzyl-2-(butylamino)-2-keto-ethyl]-keto-BLAHcarboxamide N-[(1S)-1-benzyl-2-(butylamino)-…

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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 10.51 -24.81 2 7 0 83 436.556 7 ↓

Parameters Provided:

ring.id = 230657
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 = 230657 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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