In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 24 | Yes |
Popular Name: N-[(2-ethoxyphenyl)methyl]-4-(4-methylphenoxy)butanamide N-[(2-ethoxyphenyl)methyl]-4-(4-…
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) | 3.87 | 8.65 | -13.11 | 1 | 4 | 0 | 48 | 327.424 | 9 | ↓ |
Popular Name: N,N-dimethyl-4-[2-(methylaminomethyl)phenoxy]butanamide N,N-dimethyl-4-[2-(methylaminome…
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) | 0.96 | 5.78 | -39.15 | 2 | 4 | 1 | 46 | 251.35 | 7 | ↓ |
Popular Name: 4-[2-(ethylaminomethyl)phenoxy]-N,N-dimethyl-butanamide 4-[2-(ethylaminomethyl)phenoxy]-…
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) | 1.33 | 6.65 | -38.13 | 2 | 4 | 1 | 46 | 265.377 | 8 | ↓ |
Popular Name: 4-[2-[(isopropylamino)methyl]phenoxy]-N,N-dimethyl-butanamide 4-[2-[(isopropylamino)methyl]phe…
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) | 1.63 | 7.17 | -37.29 | 2 | 4 | 1 | 46 | 279.404 | 8 | ↓ |
Popular Name: 4-[2-[(cyclopropylamino)methyl]phenoxy]-N,N-dimethyl-butanamide 4-[2-[(cyclopropylamino)methyl]p…
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) | 1.32 | 7.33 | -36.84 | 2 | 4 | 1 | 46 | 277.388 | 8 | ↓ |