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

Analogs

33741056
33741056
33741057
33741057
33784434
33784434
33784435
33784435
33871597
33871597

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-[1-[(2-fluorophenyl)methyl]indol-3-yl]propanamide N-[2-(4-ethylpiperazin-1-yl)ethy…

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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) 3.97 12.24 -43.28 2 5 1 42 437.583 9 ↓
Hi High (pH 8-9.5) 3.97 9.93 -12.82 1 5 0 41 436.575 9 ↓
Mid Mid (pH 6-8) 3.97 12.25 -45.52 2 5 1 42 437.583 9 ↓

Analogs

34878134
34878134
34878135
34878135
696784
696784
696785
696785
6704471
6704471

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-[1-(o-tolylmethyl)indol-3-yl]propanamide N-[2-(4-ethylpiperazin-1-yl)ethy…

Find On: PubMed — Wikipedia — Google

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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) 4.25 12.48 -44.36 2 5 1 42 433.62 9 ↓
Hi High (pH 8-9.5) 4.25 10.17 -13.12 1 5 0 41 432.612 9 ↓
Mid Mid (pH 6-8) 4.25 12.49 -46.94 2 5 1 42 433.62 9 ↓

Analogs

34878134
34878134
34878135
34878135
696784
696784
696785
696785
6704471
6704471

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-[1-(o-tolylmethyl)indol-3-yl]propanamide N-[2-(4-methylpiperazin-1-yl)eth…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 11.82 -45.6 2 5 1 42 419.593 8 ↓
Mid Mid (pH 6-8) 3.88 11.7 -46.84 2 5 1 42 419.593 8 ↓
Mid Mid (pH 6-8) 3.88 9.35 -13.3 1 5 0 41 418.585 8 ↓

Parameters Provided:

ring.id = 84138
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 = 84138 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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