UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

41201051
41201051
41201054
41201054
41201057
41201057
41197708
41197708
41197710
41197710

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Popular Name: N-[(R)-5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl-[(3S)-tetrahydrofuran-3-yl]methyl]cyclopropanamine N-[(R)-5,6-dihydro-4H-cyclopenta…

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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) 2.16 5.72 -34.03 2 3 1 39 265.402 4 ↓
Hi High (pH 8-9.5) 2.16 4.79 -6.54 1 3 0 34 264.394 4 ↓

Analogs

41201054
41201054
41201057
41201057
41197708
41197708
41197710
41197710
41197712
41197712

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl-[(3S)-tetrahydrofuran-3-yl]methyl]cyclopropanamine N-[(S)-5,6-dihydro-4H-cyclopenta…

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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) 2.16 5.85 -36.93 2 3 1 39 265.402 4 ↓
Hi High (pH 8-9.5) 2.16 4.79 -6.73 1 3 0 34 264.394 4 ↓

Analogs

41201057
41201057
41197708
41197708
41197710
41197710
41197712
41197712
41197714
41197714

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl-[(3R)-tetrahydrofuran-3-yl]methyl]cyclopropanamine N-[(R)-5,6-dihydro-4H-cyclopenta…

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) 2.16 5.94 -38.6 2 3 1 39 265.402 4 ↓
Hi High (pH 8-9.5) 2.16 4.82 -7.23 1 3 0 34 264.394 4 ↓

Analogs

41197708
41197708
41197710
41197710
41197712
41197712
41197714
41197714
41201048
41201048

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl-[(3R)-tetrahydrofuran-3-yl]methyl]cyclopropanamine N-[(S)-5,6-dihydro-4H-cyclopenta…

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) 2.16 5.85 -37.29 2 3 1 39 265.402 4 ↓
Hi High (pH 8-9.5) 2.16 4.29 -5.7 1 3 0 34 264.394 4 ↓

Parameters Provided:

ring.id = 521771
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 = 521771 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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