UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

4884679
4884679

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Popular Name: 1-cyclopropylcarbonyl-N-(3-methoxyphenyl)-indoline-5-sulfonamide 1-cyclopropylcarbonyl-N-(3-metho…

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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) 3.00 -3.63 -16.52 1 6 0 75 372.446 5 ↓
Hi High (pH 8-9.5) 3.00 -3.05 -53.25 0 6 -1 77 371.438 5 ↓

Analogs

4884679
4884679

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Popular Name: 1-cyclopropylcarbonyl-N-(4-methoxyphenyl)-indoline-5-sulfonamide 1-cyclopropylcarbonyl-N-(4-metho…

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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) 3.02 -3.93 -17.17 1 6 0 75 372.446 5 ↓
Hi High (pH 8-9.5) 3.02 -3.35 -51.37 0 6 -1 77 371.438 5 ↓

Analogs

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Popular Name: N-(3-chlorophenyl)-1-cyclopropylcarbonyl-indoline-5-sulfonamide N-(3-chlorophenyl)-1-cyclopropyl…

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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) 3.62 -4.09 -15.43 1 5 0 66 376.865 4 ↓

Analogs

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Popular Name: 1-cyclopropylcarbonyl-N-(2,3-dimethylphenyl)-indoline-5-sulfonamide 1-cyclopropylcarbonyl-N-(2,3-dim…

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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) 3.77 8.35 -15.98 1 5 0 66 370.474 4 ↓
Hi High (pH 8-9.5) 3.77 8.41 -55.35 0 5 -1 69 369.466 4 ↓

Analogs

34858503
34858503
35512848
35512848

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Popular Name: 1-cyclopropylcarbonyl-N-(4-ethylphenyl)-indoline-5-sulfonamide 1-cyclopropylcarbonyl-N-(4-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) 3.88 -3.21 -15.71 1 5 0 66 370.474 5 ↓
Hi High (pH 8-9.5) 3.88 -2.63 -51.32 0 5 -1 68 369.466 5 ↓

Analogs

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Popular Name: BRD-K57057676-001-01-8 BRD-K57057676-001-01-8

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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) 3.10 -3.2 -15.91 1 5 0 66 360.41 4 ↓

Parameters Provided:

ring.id = 4495
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 = 4495 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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