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

Analogs

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Popular Name: 5,7-dimethyl-3-[(N'Z)-N'-(3-methyl-1,3-benzothiazol-2-ylidene)hydrazino]indol-2-one 5,7-dimethyl-3-[(N'Z)-N'-(3-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) 0.51 9.23 -79.61 3 5 2 59 338.436 3 ↓

Analogs

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Popular Name: (3E)-5-bromo-3-[(2-phenyl-1,3-benzoxazol-5-yl)imino]indolin-2-one (3E)-5-bromo-3-[(2-phenyl-1,3-be…

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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) 5.97 6.72 -37.51 2 5 1 69 419.258 3 ↓

Analogs

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Popular Name: (3E)-3-[(5,7-dichloro-8-hydroxy-2-quinolyl)hydrazono]-5-nitro-indolin-2-one (3E)-3-[(5,7-dichloro-8-hydroxy-…

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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) 4.37 5.76 -39.06 4 9 1 134 419.204 4 ↓
Hi High (pH 8-9.5) 5.01 4.35 -106.85 1 9 -2 142 416.18 3 ↓
Mid Mid (pH 6-8) 4.55 6.4 -57.35 2 9 -1 139 417.188 3 ↓

Analogs

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Popular Name: 2-[(N'E)-N'-(7-iodo-2-oxo-indolin-3-ylidene)hydrazino]benzoic 2-[(N'E)-N'-(7-iodo-2-oxo-indoli…

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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) 3.90 7.19 -37.38 3 6 0 95 407.167 4 ↓

Analogs

13128619
13128619

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Popular Name: 1-[4-(1,3-dioxoisoindolin-2-yl)butylsulfanyl]-N'-[(2-oxoindolin-3-ylidene)amino]-N-[[(2S)-tetrahydro 1-[4-(1,3-dioxoisoindolin-2-yl)b…

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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) 3.87 9.96 -35.13 3 9 1 120 506.608 10 ↓
Hi High (pH 8-9.5) 4.32 8.13 -40.9 2 9 0 123 505.6 10 ↓
Hi High (pH 8-9.5) 3.87 10.01 -32.03 3 9 1 120 506.608 10 ↓

Analogs

13128618
13128618

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Popular Name: 1-[4-(1,3-dioxoisoindolin-2-yl)butylsulfanyl]-N'-[(2-oxoindolin-3-ylidene)amino]-N-[[(2R)-tetrahydro 1-[4-(1,3-dioxoisoindolin-2-yl)b…

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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) 3.87 9.98 -34.98 3 9 1 120 506.608 10 ↓
Hi High (pH 8-9.5) 4.32 8.17 -40.76 2 9 0 123 505.6 10 ↓
Hi High (pH 8-9.5) 3.87 9.93 -31.33 3 9 1 120 506.608 10 ↓

Analogs

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Popular Name: 2-amino-9-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-[(N'E)-N'-(2-oxoindo 2-amino-9-[(2R,3S,4S,5R)-3,4-dih…

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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 -4.18 -39.67 9 14 1 215 443.4 5 ↓

Analogs

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Popular Name: 2-amino-9-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-[(N'E)-N'-(2-oxoindo 2-amino-9-[(2S,3S,4S,5R)-3,4-dih…

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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 -4.41 -39.72 9 14 1 215 443.4 5 ↓

Analogs

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Popular Name: 4-(2-hydroxyethyl)indol-2-one 4-(2-hydroxyethyl)indol-2-one

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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) 1.08 1.04 -32.31 2 3 1 51 176.195 2 ↓

Parameters Provided:

ring.id = 1776
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 = 1776 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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