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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-2-[(1S,2R,4R)-2,4-dimethylcyclohexyl]isoquinolin-1-one 3-amino-2-[(1S,2R,4R)-2,4-dimeth…

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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) 3.54 8.81 -5.15 2 3 0 48 270.376 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-2-[(1S,2R,4S)-2,4-dimethylcyclohexyl]isoquinolin-1-one 3-amino-2-[(1S,2R,4S)-2,4-dimeth…

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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) 3.54 9.04 -8.77 2 3 0 48 270.376 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-2-[(1R,2R,4R)-2,4-dimethylcyclohexyl]isoquinolin-1-one 3-amino-2-[(1R,2R,4R)-2,4-dimeth…

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) 3.54 9.36 -9.55 2 3 0 48 270.376 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-2-[(1R,2R,4S)-2,4-dimethylcyclohexyl]isoquinolin-1-one 3-amino-2-[(1R,2R,4S)-2,4-dimeth…

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) 3.54 9.12 -8.95 2 3 0 48 270.376 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-2-(4-propylcyclohexyl)isoquinolin-1-one 3-amino-2-(4-propylcyclohexyl)is…

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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) 4.31 9.25 -4.96 2 3 0 48 284.403 3 ↓