UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5'-ethyl-7'-methyl-1-(2,4,6-trimethylphenyl)sulfonyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline 5'-ethyl-7'-methyl-1-(2,4,6-trim…

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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) 5.93 12.87 -10.78 0 5 0 46 463.647 3 ↓

Analogs

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Popular Name: 5'-ethyl-1-(4-methoxyphenyl)sulfonyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 5'-ethyl-1-(4-methoxyphenyl)sulf…

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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) 4.79 10.07 -12.39 0 6 0 55 451.592 4 ↓

Analogs

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Popular Name: 5'-ethyl-7'-methyl-1-(p-tolylsulfonyl)spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 5'-ethyl-7'-methyl-1-(p-tolylsul…

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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) 5.18 11.45 -11.81 0 5 0 46 435.593 3 ↓

Analogs

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Popular Name: 1-(4-tert-butylphenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(4-tert-butylphenyl)sulfonyl-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) 6.44 13.1 -11.27 0 5 0 46 477.674 4 ↓

Analogs

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Popular Name: 6-(5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)sulfonyl-3-methyl-1,3-be 6-(5'-ethyl-7'-methyl-spiro[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) 4.01 11.13 -16.59 0 8 0 81 492.601 3 ↓

Analogs

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Popular Name: 1-benzylsulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-benzylsulfonyl-5'-ethyl-7'-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) 4.79 11.9 -12.98 0 5 0 46 435.593 4 ↓

Analogs

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Popular Name: 1-(2,5-dimethoxyphenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(2,5-dimethoxyphenyl)sulfonyl-…

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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) 4.77 10.32 -13.21 0 7 0 64 481.618 5 ↓

Analogs

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Popular Name: 1-(3,4-dimethoxyphenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(3,4-dimethoxyphenyl)sulfonyl-…

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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) 4.38 10.37 -13.54 0 7 0 64 481.618 5 ↓

Analogs

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Popular Name: 1-[(5-chloro-2-thienyl)sulfonyl]-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-[(5-chloro-2-thienyl)sulfonyl]…

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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) 5.48 10.78 -10.18 0 5 0 46 462.04 3 ↓

Analogs

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Popular Name: 5'-ethyl-7'-methyl-1-tetralin-6-ylsulfonyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 5'-ethyl-7'-methyl-1-tetralin-6-…

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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) 5.91 13.66 -10.69 0 5 0 46 475.658 3 ↓

Analogs

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Popular Name: 1-(3,4-dimethylphenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(3,4-dimethylphenyl)sulfonyl-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) 5.55 12.37 -11.03 0 5 0 46 449.62 3 ↓

Analogs

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Popular Name: 1-(5-chloro-2-methoxy-phenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxa 1-(5-chloro-2-methoxy-phenyl)sul…

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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) 5.39 11.55 -11.49 0 6 0 55 486.037 4 ↓

Analogs

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Popular Name: 1-(3-chloro-4-methoxy-phenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxa 1-(3-chloro-4-methoxy-phenyl)sul…

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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) 5.39 11.03 -11.92 0 6 0 55 486.037 4 ↓

Analogs

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Popular Name: 1-(2-chlorophenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(2-chlorophenyl)sulfonyl-5'-et…

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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) 5.36 11.22 -11.42 0 5 0 46 456.011 3 ↓

Analogs

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Popular Name: 4-(5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)sulfonyl-3,5-dimethyl-is 4-(5'-ethyl-7'-methyl-spiro[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) 3.59 9.65 -13.08 0 7 0 72 440.569 3 ↓

Analogs

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Popular Name: (2-bromophenyl)-(5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)methanone (2-bromophenyl)-(5'-ethyl-7'-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) 5.14 13.71 -13.38 0 4 0 28 464.407 2 ↓

Analogs

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Popular Name: (5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)-(4-methoxyphenyl)methanon (5'-ethyl-7'-methyl-spiro[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) 4.44 12.03 -11.93 0 5 0 38 415.537 3 ↓

Analogs

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Popular Name: 1-(5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)-2-(2-thienyl)ethanone 1-(5'-ethyl-7'-methyl-spiro[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) 4.85 13.29 -13.6 0 4 0 28 405.567 3 ↓

Analogs

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Popular Name: (5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)-(4-fluorophenyl)methanone (5'-ethyl-7'-methyl-spiro[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) 4.55 12.8 -11.2 0 4 0 28 403.501 2 ↓

Analogs

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Popular Name: 1-(benzenesulfonyl)-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(benzenesulfonyl)-5'-ethyl-7'-…

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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) 4.73 10.77 -11.99 0 5 0 46 421.566 3 ↓

Analogs

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Popular Name: 5'-ethyl-1-(4-isopropylphenyl)sulfonyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 5'-ethyl-1-(4-isopropylphenyl)su…

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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) 6.24 12.71 -11.35 0 5 0 46 463.647 4 ↓

Analogs

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Popular Name: 5'-ethyl-1-(4-ethylphenyl)sulfonyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 5'-ethyl-1-(4-ethylphenyl)sulfon…

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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) 5.64 12.56 -11.91 0 5 0 46 449.62 4 ↓

Analogs

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Popular Name: 1-(3-chlorophenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(3-chlorophenyl)sulfonyl-5'-et…

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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) 5.38 11.69 -10.56 0 5 0 46 456.011 3 ↓

Analogs

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Popular Name: 1,3-benzodioxol-5-yl-(5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-yl)metha 1,3-benzodioxol-5-yl-(5'-ethyl-7…

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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) 4.27 11.78 -14.97 0 6 0 47 429.52 2 ↓

Analogs

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Popular Name: 5'-ethyl-1-ethylsulfonyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 5'-ethyl-1-ethylsulfonyl-7'-meth…

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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) 3.57 8.87 -11.49 0 5 0 46 373.522 3 ↓

Analogs

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Popular Name: 1-(4-ethoxyphenyl)sulfonyl-5'-ethyl-7'-methyl-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] 1-(4-ethoxyphenyl)sulfonyl-5'-et…

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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) 5.16 11.39 -11.58 0 6 0 55 465.619 5 ↓

Analogs

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Popular Name: tert-butyl 11'-methoxy-2',8'-diazaspiro[piperidine- 4,7'-tricyclo[7.4.0.0^{2,6}]tridecane]- 1'(9'),10',12'-triene-1-carboxylate tert-butyl 11'-methoxy-2',8'-dia…

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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) 3.84 9.07 -9.1 1 6 0 56 369.465 3 ↓

Analogs

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Popular Name: 7,8-dimethoxy-4,5-dihydrospiro[pyrrolo(1,2-a)quinoxaline-4,4'-piperidine] hydrochloride 7,8-dimethoxy-4,5-dihydrospiro[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) 2.02 5.84 -52.43 3 5 1 52 300.382 2 ↓

Analogs

34563397
34563397

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Popular Name: 7-methyl-4,5-dihydrospiro[pyrrolo(1,2-a)quinoxaline-4,4'-piperidine] hydrochloride 7-methyl-4,5-dihydrospiro[pyrrol…

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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) 2.61 7.31 -47.56 3 3 1 34 254.357 0 ↓

Analogs

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Popular Name: methyl 4,5-dihydrospiro[pyrrolo(1,2-a)quinoxaline-4,4'-piperidine]-7-carboxylate hydrochloride methyl 4,5-dihydrospiro[pyrrolo(…

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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) 2.33 7.27 -48.48 3 5 1 60 298.366 2 ↓

Analogs

35475949
35475949
35475950
35475950

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Popular Name: 2-(o-tolyl)-1-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl-ethanone 2-(o-tolyl)-1-spiro[5H-pyrrolo[1…

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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) 4.30 12.19 -11.1 1 4 0 37 371.484 2 ↓

Analogs

35446684
35446684
35446739
35446739

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Popular Name: methyl methyl

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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) 4.43 11.29 -14.27 2 7 0 76 434.471 3 ↓

Analogs

35446744
35446744
35446804
35446804
35446834
35446834
35446840
35446840
35446846
35446846

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Popular Name: 7-methoxy-N-(2-methoxyphenyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carboxamide 7-methoxy-N-(2-methoxyphenyl)spi…

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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) 4.17 9.2 -12.3 2 7 0 68 418.497 3 ↓

Analogs

35446635
35446635
35446834
35446834
35446837
35446837
35446840
35446840
35446843
35446843

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Popular Name: N-(2-chlorophenyl)-7-methoxy-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carboxamide N-(2-chlorophenyl)-7-methoxy-spi…

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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) 4.79 10.39 -10.48 2 6 0 59 422.916 2 ↓

Analogs

35446635
35446635
35446726
35446726
35446770
35446770
35446795
35446795

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Popular Name: N-(2,3-dimethylphenyl)-7-methoxy-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carboxamide N-(2,3-dimethylphenyl)-7-methoxy…

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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) 4.96 11.22 -13.26 2 6 0 59 416.525 2 ↓

Analogs

35446656
35446656
35446761
35446761
35446851
35446851
35446891
35446891

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Popular Name: ethyl ethyl

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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) 4.84 11.72 -12.1 2 8 0 85 460.534 5 ↓

Analogs

35446726
35446726
35446834
35446834
35446837
35446837
35446840
35446840
35446843
35446843

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Popular Name: N-(3-fluoro-4-methyl-phenyl)-7-methoxy-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carbox N-(3-fluoro-4-methyl-phenyl)-7-m…

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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) 4.70 10.56 -15.87 2 6 0 59 420.488 2 ↓

Parameters Provided:

ring.id = 17171
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 = 17171 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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