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

Analogs

12402398
12402398

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Popular Name: (5S)-2,2-dimethyl-5-[4-(1H-tetrazol-5-yl)phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one (5S)-2,2-dimethyl-5-[4-(1H-tetra…

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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) 4.68 1.03 -47.28 1 6 -1 82 420.496 2 ↓

Analogs

12402397
12402397

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Popular Name: (5R)-2,2-dimethyl-5-[4-(1H-tetrazol-5-yl)phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one (5R)-2,2-dimethyl-5-[4-(1H-tetra…

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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) 4.68 1.06 -46.68 1 6 -1 82 420.496 2 ↓

Analogs

16577958
16577958

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Popular Name: (5R)-5-[[5-(2-chloro-5-nitro-phenyl)-2-furyl]methyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanth (5R)-5-[[5-(2-chloro-5-nitro-phe…

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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) 7.87 16.23 -11.37 1 6 0 88 512.993 4 ↓

Analogs

16577955
16577955

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Popular Name: (5S)-5-[[5-(2-chloro-5-nitro-phenyl)-2-furyl]methyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanth (5S)-5-[[5-(2-chloro-5-nitro-phe…

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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) 7.87 16.28 -13.83 1 6 0 88 512.993 4 ↓

Analogs

6077112
6077112
6077189
6077189

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Popular Name: (5R)-5-(6-chloro-4H-1,3-benzodioxin-8-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one (5R)-5-(6-chloro-4H-1,3-benzodio…

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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) 5.64 12.98 -9.05 1 4 0 48 445.946 1 ↓

Analogs

6077112
6077112
6077189
6077189

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Popular Name: (5S)-5-(6-chloro-4H-1,3-benzodioxin-8-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one (5S)-5-(6-chloro-4H-1,3-benzodio…

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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) 5.64 12.93 -9.75 1 4 0 48 445.946 1 ↓

Analogs

16577970
16577970

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Popular Name: 4-chloro-2-[5-[(5S)-2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl]-2-furyl]benzoic 4-chloro-2-[5-[(5S)-2,2-dimethyl…

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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) 6.60 15.12 -58.05 1 5 -1 82 496.97 3 ↓

Analogs

16577967
16577967

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Popular Name: 4-chloro-2-[5-[(5R)-2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl]-2-furyl]benzoic 4-chloro-2-[5-[(5R)-2,2-dimethyl…

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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) 6.60 15.12 -57.09 1 5 -1 82 496.97 3 ↓

Analogs

16577976
16577976

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Popular Name: (5R)-5-[5-(5-chloro-2-methoxy-phenyl)-2-furyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin- (5R)-5-[5-(5-chloro-2-methoxy-ph…

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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) 7.09 14.3 -13.04 1 4 0 51 483.995 3 ↓

Analogs

16577973
16577973

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Popular Name: (5S)-5-[5-(5-chloro-2-methoxy-phenyl)-2-furyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin- (5S)-5-[5-(5-chloro-2-methoxy-ph…

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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) 7.09 14.2 -13 1 4 0 51 483.995 3 ↓

Parameters Provided:

ring.id = 101139
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 = 101139 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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