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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[2-(3,4-diethoxyphenyl)ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[2-(3,4-diethoxyphenyl)ethyl]t…

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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) 2.30 6.46 -22.09 1 8 0 86 328.376 8 ↓

Analogs

14254755
14254755

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Popular Name: (1S)-1-(3-methoxyphenyl)-N,N-dimethyl-N'-(tetrazolo[5,1-f]pyridazin-6-yl)ethane-1,2-diamine (1S)-1-(3-methoxyphenyl)-N,N-dim…

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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) 1.74 5.55 -60.2 2 8 1 82 314.373 6 ↓

Analogs

14254752
14254752

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Popular Name: (1R)-1-(3-methoxyphenyl)-N,N-dimethyl-N'-(tetrazolo[5,1-f]pyridazin-6-yl)ethane-1,2-diamine (1R)-1-(3-methoxyphenyl)-N,N-dim…

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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) 1.74 5.9 -59.66 2 8 1 82 314.373 6 ↓

Analogs

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Popular Name: (1R)-1-(4-fluorophenyl)-N,N-dimethyl-N'-(tetrazolo[5,1-f]pyridazin-6-yl)ethane-1,2-diamine (1R)-1-(4-fluorophenyl)-N,N-dime…

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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) 1.87 6.57 -59.25 2 7 1 72 302.337 5 ↓
Mid Mid (pH 6-8) 1.87 4.57 -17.62 1 7 0 71 301.329 5 ↓

Analogs

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Popular Name: (1S)-1-(4-fluorophenyl)-N,N-dimethyl-N'-(tetrazolo[5,1-f]pyridazin-6-yl)ethane-1,2-diamine (1S)-1-(4-fluorophenyl)-N,N-dime…

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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) 1.87 6.59 -60.23 2 7 1 72 302.337 5 ↓
Mid Mid (pH 6-8) 1.87 4.06 -16.52 1 7 0 71 301.329 5 ↓

Analogs

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Popular Name: N-methyl-N-phenethyl-tetrazolo[5,1-f]pyridazin-6-amine N-methyl-N-phenethyl-tetrazolo[5…

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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) 2.15 7.19 -17.01 0 6 0 59 254.297 4 ↓

Analogs

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Popular Name: 4-[2-(tetrazolo[5,1-f]pyridazin-6-ylamino)ethyl]phenol 4-[2-(tetrazolo[5,1-f]pyridazin-…

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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) 1.42 2.57 -19.96 2 7 0 88 256.269 4 ↓

Analogs

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Popular Name: (1S)-1-(3-fluorophenyl)-2-(tetrazolo[5,1-f]pyridazin-6-ylamino)ethanol (1S)-1-(3-fluorophenyl)-2-(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) 1.05 2.31 -18.25 2 7 0 88 274.259 4 ↓

Analogs

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Popular Name: (1R)-1-(3-fluorophenyl)-2-(tetrazolo[5,1-f]pyridazin-6-ylamino)ethanol (1R)-1-(3-fluorophenyl)-2-(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) 1.05 2.39 -18.05 2 7 0 88 274.259 4 ↓

Analogs

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Popular Name: N-[2-(3,5-dichlorophenyl)ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[2-(3,5-dichlorophenyl)ethyl]t…

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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) 3.18 6.43 -18.56 1 6 0 68 309.16 4 ↓

Analogs

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Popular Name: N-[2-(3-bromo-4-fluoro-phenyl)ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[2-(3-bromo-4-fluoro-phenyl)et…

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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) 2.80 6.08 -20.53 1 6 0 68 337.156 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(3-chlorophenyl)-1-methyl-ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[(1S)-2-(3-chlorophenyl)-1-met…

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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) 2.88 6.85 -19.51 1 6 0 68 288.742 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(3-chlorophenyl)-1-methyl-ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[(1R)-2-(3-chlorophenyl)-1-met…

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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) 2.88 6.85 -16.24 1 6 0 68 288.742 4 ↓

Analogs

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Popular Name: N-[2-(2,3-dichlorophenyl)ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[2-(2,3-dichlorophenyl)ethyl]t…

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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) 3.16 6.26 -19.1 1 6 0 68 309.16 4 ↓

Analogs

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Popular Name: N-[2-(2-chlorophenyl)ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[2-(2-chlorophenyl)ethyl]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) 2.53 5.83 -17.32 1 6 0 68 274.715 4 ↓

Analogs

42110092
42110092

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Popular Name: (1S)-1-(p-tolyl)-2-(tetrazolo[5,1-f]pyridazin-6-ylamino)ethanol (1S)-1-(p-tolyl)-2-(tetrazolo[5,…

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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) 1.36 2.91 -16.52 2 7 0 88 270.296 4 ↓

Analogs

42110089
42110089

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Popular Name: (1R)-1-(p-tolyl)-2-(tetrazolo[5,1-f]pyridazin-6-ylamino)ethanol (1R)-1-(p-tolyl)-2-(tetrazolo[5,…

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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) 1.36 3 -16.49 2 7 0 88 270.296 4 ↓

Parameters Provided:

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filter.purchasability = annotated
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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 = 86024 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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