In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 35 | Yes |
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) | 2.85 | 11.01 | -66.1 | 3 | 7 | 1 | 99 | 475.613 | 7 | ↓ |
Popular Name: N-benzyl-1-[2-(4-cyanophenoxy)propanoyl]piperidine-4-carboxamide N-benzyl-1-[2-(4-cyanophenoxy)pr…
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) | 2.74 | 0.69 | -21.49 | 1 | 6 | 0 | 82 | 391.471 | 6 | ↓ |
Popular Name: N-benzyl-1-[2-(4-cyanophenoxy)propanoyl]piperidine-4-carboxamide N-benzyl-1-[2-(4-cyanophenoxy)pr…
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) | 2.74 | 0.64 | -21.92 | 1 | 6 | 0 | 82 | 391.471 | 6 | ↓ |
Popular Name: butanamide, N-(3-amino-3-oxopropyl)-2-phenoxy-N-(phenylmethyl)- butanamide, N-(3-amino-3-oxoprop…
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) | 2.61 | 7.82 | -16.31 | 2 | 5 | 0 | 73 | 340.423 | 9 | ↓ |
Popular Name: butanamide, N-(3-amino-3-oxopropyl)-2-phenoxy-N-(phenylmethyl)- butanamide, N-(3-amino-3-oxoprop…
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) | 2.61 | 8.02 | -15.74 | 2 | 5 | 0 | 73 | 340.423 | 9 | ↓ |
Popular Name: N-[(1-benzyl-5-oxo-pyrrolidin-3-yl)methyl]-2-(4-ethoxyphenoxy)-acetamide N-[(1-benzyl-5-oxo-pyrrolidin-3-…
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) | 2.79 | -0.92 | -20.39 | 1 | 6 | 0 | 67 | 382.46 | 9 | ↓ |
Popular Name: N-[(1-benzyl-5-oxo-pyrrolidin-3-yl)methyl]-2-(4-ethoxyphenoxy)-acetamide N-[(1-benzyl-5-oxo-pyrrolidin-3-…
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) | 2.79 | -0.86 | -22.26 | 1 | 6 | 0 | 67 | 382.46 | 9 | ↓ |
Popular Name: N-[(1-benzyl-5-oxo-pyrrolidin-3-yl)methyl]-2-(4-methoxyphenoxy)-acetamide N-[(1-benzyl-5-oxo-pyrrolidin-3-…
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) | 2.41 | -0.94 | -20.56 | 1 | 6 | 0 | 67 | 368.433 | 8 | ↓ |
Popular Name: N-[(1-benzyl-5-oxo-pyrrolidin-3-yl)methyl]-2-(4-methoxyphenoxy)-acetamide N-[(1-benzyl-5-oxo-pyrrolidin-3-…
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) | 2.41 | -0.87 | -22.41 | 1 | 6 | 0 | 67 | 368.433 | 8 | ↓ |
Popular Name: N-[(1-benzyl-5-oxo-pyrrolidin-3-yl)methyl]-2-phenoxy-acetamide N-[(1-benzyl-5-oxo-pyrrolidin-3-…
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) | 2.35 | -0.94 | -19.33 | 1 | 5 | 0 | 58 | 338.407 | 7 | ↓ |