UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-methyl-2-oxo-spiro[indoline-3,4'-piperidine]-1'-carboxamide N-methyl-2-oxo-spiro[indoline-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) 1.60 3.48 -11.99 2 5 0 61 259.309 0 ↓

Analogs

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Popular Name: 1-phenylspiro[indoline-3,4'-piperidine]-2-one 1-phenylspiro[indoline-3,4'-pipe…

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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) 2.75 8.85 -43.94 2 3 1 37 279.363 1 ↓

Analogs

33824253
33824253
33824254
33824254
33824255
33824255
33824256
33824256
33824257
33824257

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Popular Name: Spiro[indoline-3,4'-piperidin]-2-one Spiro[indoline-3,4'-piperidin]-2…

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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) 0.81 3.42 -41.11 3 3 1 46 203.265 0 ↓

Analogs

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Popular Name: 1'-Boc-1,2-dihydro-2-oxo-spiro[3H-indole-3,4'-piperidine] 1'-Boc-1,2-dihydro-2-oxo-spiro[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) 2.44 6.43 -8.45 1 5 0 59 302.374 2 ↓

Analogs

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Popular Name: 1'-BOC-5-CHLORO-1,2-DIHYDRO-2-OXO-SPIRO[3H-INDOLE-3,4'-PIPERIDINE] 1'-BOC-5-CHLORO-1,2-DIHYDRO-2-OX…

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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 6.97 -8.07 1 5 0 59 336.819 2 ↓

Analogs

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Popular Name: 1'-Boc-5-Fluoro-1,2-dihydro-2-oxo-spiro[3H-indole-3,4'-piperidine] 1'-Boc-5-Fluoro-1,2-dihydro-2-ox…

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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) 2.58 6.52 -8.55 1 5 0 59 320.364 2 ↓

Analogs

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Popular Name: 5-Bromo-1'-methylspiro[indoline-3,4'-piperidin]-2-one 5-Bromo-1'-methylspiro[indoline-…

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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) 2.19 6.27 -36.87 2 3 1 34 296.188 0 ↓
Hi High (pH 8-9.5) 2.19 3.86 -5.2 1 3 0 32 295.18 0 ↓

Analogs

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Popular Name: 1'-Boc-5-Bromo-1,2-dihydro-2-oxo-spiro[3H-indole-3,4'-piperidine] 1'-Boc-5-Bromo-1,2-dihydro-2-oxo…

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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) 3.22 7.08 -7.98 1 5 0 59 381.27 2 ↓

Analogs

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Popular Name: 1'-Boc-1,2-dihydro-5-methoxy-2-oxo-spiro[3H-indole-3,4'-piperidine] 1'-Boc-1,2-dihydro-5-methoxy-2-o…

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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) 2.47 5.72 -9.27 1 6 0 68 332.4 3 ↓

Analogs

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Popular Name: 1-methylspiro[indole-3,4'-piperidin]-2(1H)-one 1-methylspiro[indole-3,4'-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) 1.05 5.4 -41.44 2 3 1 37 217.292 0 ↓

Parameters Provided:

ring.id = 368236
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 = 368236 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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