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

Analogs

61721396
61721396
61721397
61721397
61721398
61721398
61721399
61721399
40384
40384

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[cyclopropyl(4-pyridylmethyl)carbamoyl]cyclopropanecarboxylic (1S,2R)-2-[cyclopropyl(4-pyridyl…

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) 0.49 6.97 -53.12 0 5 -1 73 259.285 5 ↓
Lo Low (pH 4.5-6) 0.49 7.43 -69.62 1 5 0 75 260.293 5 ↓
Lo Low (pH 4.5-6) 0.49 5.04 -14.84 1 5 0 71 260.293 5 ↓

Analogs

61721396
61721396
61721397
61721397
61721398
61721398
61721399
61721399
40384
40384

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[cyclopropyl(4-pyridylmethyl)carbamoyl]cyclopropanecarboxylic (1S,2S)-2-[cyclopropyl(4-pyridyl…

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) 0.49 7.05 -51.25 0 5 -1 73 259.285 5 ↓
Lo Low (pH 4.5-6) 0.49 7.51 -64.81 1 5 0 75 260.293 5 ↓
Lo Low (pH 4.5-6) 0.49 5.04 -11.05 1 5 0 71 260.293 5 ↓

Analogs

61721396
61721396
61721397
61721397
61721398
61721398
61721399
61721399
40384
40384

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[cyclopropyl(4-pyridylmethyl)carbamoyl]cyclopropanecarboxylic (1R,2R)-2-[cyclopropyl(4-pyridyl…

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) 0.49 7.04 -50.11 0 5 -1 73 259.285 5 ↓
Lo Low (pH 4.5-6) 0.49 7.5 -69.71 1 5 0 75 260.293 5 ↓
Lo Low (pH 4.5-6) 0.49 5.05 -10.15 1 5 0 71 260.293 5 ↓

Analogs

61721396
61721396
61721397
61721397
61721398
61721398
61721399
61721399
40384
40384

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[cyclopropyl(4-pyridylmethyl)carbamoyl]cyclopropanecarboxylic (1R,2S)-2-[cyclopropyl(4-pyridyl…

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) 0.49 6.98 -55.3 0 5 -1 73 259.285 5 ↓
Lo Low (pH 4.5-6) 0.49 7.44 -47.41 1 5 0 75 260.293 5 ↓
Lo Low (pH 4.5-6) 0.49 5.02 -14.82 1 5 0 71 260.293 5 ↓

Parameters Provided:

ring.id = 580577
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 = 580577 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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