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

Analogs

28182855
28182855
20649180
20649180
20647490
20647490

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Popular Name: (2Z)-4-methyl-2-[(1-methylindol-3-yl)methylene]-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3-f][1,3]ben (2Z)-4-methyl-2-[(1-methylindol-…

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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) 3.32 7.47 -12.14 0 7 0 60 459.546 4 ↓
Mid Mid (pH 6-8) 3.32 9.73 -54.19 1 7 1 61 460.554 4 ↓

Analogs

20649180
20649180
28182855
28182855
22935496
22935496

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Popular Name: (2Z)-2-[(1-ethylindol-3-yl)methylene]-4-methyl-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3-f][1,3]benz (2Z)-2-[(1-ethylindol-3-yl)methy…

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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) 3.69 8.39 -11.79 0 7 0 60 473.573 5 ↓
Mid Mid (pH 6-8) 3.69 10.66 -54.05 1 7 1 61 474.581 5 ↓

Analogs

20649929
20649929
28182826
28182826
28182447
28182447

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-4-methyl-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3 (2Z)-2-[(5-methoxy-1-methyl-indo…

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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) 3.35 6.76 -14.21 0 8 0 69 489.572 5 ↓
Mid Mid (pH 6-8) 3.35 9.02 -57.1 1 8 1 71 490.58 5 ↓

Analogs

28182826
28182826
20649929
20649929
22935512
22935512

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylene]-4-methyl-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3- (2Z)-2-[(1-ethyl-5-methoxy-indol…

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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) 3.73 7.68 -13.84 0 8 0 69 503.599 6 ↓
Mid Mid (pH 6-8) 3.73 9.94 -56.87 1 8 1 71 504.607 6 ↓

Analogs

28182518
28182518
20647490
20647490
20648888
20648888

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Popular Name: (2Z)-2-[(1-methylindol-3-yl)methylene]-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3-f][1,3]benzoxazin-3 (2Z)-2-[(1-methylindol-3-yl)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) 2.94 6.82 -12.25 0 7 0 60 445.519 4 ↓
Mid Mid (pH 6-8) 2.94 9.09 -54.47 1 7 1 61 446.527 4 ↓

Analogs

20649180
20649180
28182855
28182855
22935496
22935496

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-2-[(1-ethylindol-3-yl)methylene]-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3-f][1,3]benzoxazin-3- (2Z)-2-[(1-ethylindol-3-yl)methy…

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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) 3.32 7.74 -11.89 0 7 0 60 459.546 5 ↓
Mid Mid (pH 6-8) 3.32 10.01 -54.32 1 7 1 61 460.554 5 ↓

Analogs

20649412
20649412
28182447
28182447

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3-f][1,3]b (2Z)-2-[(5-methoxy-1-methyl-indo…

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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) 2.97 6.11 -14.36 0 8 0 69 475.545 5 ↓
Mid Mid (pH 6-8) 2.97 8.38 -57.4 1 8 1 71 476.553 5 ↓

Analogs

28182826
28182826
20649929
20649929
22935512
22935512

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylene]-8-(2-morpholinoethyl)-7,9-dihydrofuro[2,3-f][1,3]be (2Z)-2-[(1-ethyl-5-methoxy-indol…

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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) 3.35 7.03 -13.94 0 8 0 69 489.572 6 ↓
Mid Mid (pH 6-8) 3.35 9.29 -57.13 1 8 1 71 490.58 6 ↓

Parameters Provided:

ring.id = 561888
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 = 561888 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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