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Analogs

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Popular Name: 2-[cyclopentyl-(1-methyltetrazol-5-yl)amino]acetic 2-[cyclopentyl-(1-methyltetrazol…

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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) -0.53 6.61 -52.02 0 7 -1 87 224.244 4 ↓

Analogs

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Popular Name: 1-[(1-methyltetrazol-5-yl)amino]cyclopentanecarboxylic 1-[(1-methyltetrazol-5-yl)amino]…

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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) -1.77 4.44 -55.07 1 7 -1 96 210.217 3 ↓

Analogs

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Popular Name: N-cyclopentyl-N-(1-methyltetrazol-5-yl)propane-1,3-diamine N-cyclopentyl-N-(1-methyltetrazo…

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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) 0.22 4.05 -52.3 3 6 1 74 225.32 5 ↓

Analogs

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Popular Name: 1-methyl-N-(1-methylcyclopentyl)tetrazol-5-amine 1-methyl-N-(1-methylcyclopentyl)…

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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) 1.34 4.8 -9.24 1 5 0 56 181.243 2 ↓

Analogs

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Popular Name: N-[(1R,2S)-2-methoxycyclopentyl]-1-methyl-tetrazol-5-amine N-[(1R,2S)-2-methoxycyclopentyl]…

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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) 0.36 4.19 -8.03 1 6 0 65 197.242 3 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-methoxycyclopentyl]-1-methyl-tetrazol-5-amine N-[(1S,2S)-2-methoxycyclopentyl]…

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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) 0.36 3.76 -10.84 1 6 0 65 197.242 3 ↓

Analogs

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Popular Name: N-[(1R,2R)-2-methoxycyclopentyl]-1-methyl-tetrazol-5-amine N-[(1R,2R)-2-methoxycyclopentyl]…

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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) 0.36 3.75 -10.85 1 6 0 65 197.242 3 ↓

Analogs

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Popular Name: N-[(1S,2R)-2-methoxycyclopentyl]-1-methyl-tetrazol-5-amine N-[(1S,2R)-2-methoxycyclopentyl]…

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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) 0.36 4.1 -8.36 1 6 0 65 197.242 3 ↓

Analogs

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Popular Name: [1-[(1-methyltetrazol-5-yl)amino]cyclopentyl]methanol [1-[(1-methyltetrazol-5-yl)amino…

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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) 0.33 1.45 -9.39 2 6 0 76 197.242 3 ↓

Analogs

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Popular Name: 2-[cyclopentyl-(1-methyltetrazol-5-yl)amino]ethanol 2-[cyclopentyl-(1-methyltetrazol…

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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) 0.51 2.59 -9.57 1 6 0 67 211.269 4 ↓

Analogs

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Popular Name: N-cyclopentyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine N-cyclopentyl-N-(1-methyltetrazo…

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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) -0.06 3.28 -55.24 3 6 1 74 211.293 4 ↓
Hi High (pH 8-9.5) -0.06 2.89 -8.71 2 6 0 73 210.285 4 ↓

Parameters Provided:

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filter.purchasability = annotated
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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 = 312129 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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