| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2010 | 31 | Yes |
Popular Name: N-[(1S)-1-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]-3-methyl-benzamide N-[(1S)-1-[1-[2-(azepan-1-yl)-2-…
| 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) | 3.94 | 11.96 | -15.28 | 1 | 6 | 0 | 67 | 418.541 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.94 | 12.32 | -34.25 | 2 | 6 | 1 | 68 | 419.549 | 5 | ↓ |
Popular Name: N-[1-[1-(cyclohexylcarbamoylmethyl)benzoimidazol-2-yl]ethyl]-4-methyl-benzamide N-[1-[1-(cyclohexylcarbamoylmeth…
| 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) | 4.21 | 10.57 | -17.53 | 2 | 6 | 0 | 76 | 418.541 | 6 | ↓ |
Popular Name: N-[1-[1-(cyclohexylcarbamoylmethyl)benzoimidazol-2-yl]ethyl]-4-methyl-benzamide N-[1-[1-(cyclohexylcarbamoylmeth…
| 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) | 4.21 | 10.57 | -15.85 | 2 | 6 | 0 | 76 | 418.541 | 6 | ↓ |
Popular Name: N-[1-[1-(1-ethylpropylcarbamoylmethyl)benzoimidazol-2-yl]ethyl]benzamide N-[1-[1-(1-ethylpropylcarbamoylm…
| 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) | 3.60 | -1.67 | -15.18 | 2 | 6 | 0 | 76 | 392.503 | 8 | ↓ |
Popular Name: N-[(1S)-1-[1-[2-(1-ethylpropylamino)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]benzamide N-[(1S)-1-[1-[2-(1-ethylpropylam…
| 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) | 3.60 | 9.59 | -16.71 | 2 | 6 | 0 | 76 | 392.503 | 8 | ↓ |
Popular Name: N-[(1S)-1-[1-[2-(1-ethylpropylamino)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide N-[(1S)-1-[1-[2-(1-ethylpropylam…
| 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) | 4.05 | 10.26 | -16.28 | 2 | 6 | 0 | 76 | 406.53 | 8 | ↓ |
Popular Name: N-[(1R)-1-[1-[2-(1-ethylpropylamino)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide N-[(1R)-1-[1-[2-(1-ethylpropylam…
| 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) | 4.05 | 10.27 | -15 | 2 | 6 | 0 | 76 | 406.53 | 8 | ↓ |
Popular Name: 4-methyl-N-[(1R)-1-[1-(2-oxo-2-propylamino-ethyl)benzimidazol-2-yl]ethyl]benzamide 4-methyl-N-[(1R)-1-[1-(2-oxo-2-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) | 3.19 | 8.64 | -17.6 | 2 | 6 | 0 | 76 | 378.476 | 7 | ↓ |
Popular Name: 4-methyl-N-[(1S)-1-[1-(2-oxo-2-propylamino-ethyl)benzimidazol-2-yl]ethyl]benzamide 4-methyl-N-[(1S)-1-[1-(2-oxo-2-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) | 3.19 | 8.64 | -17.61 | 2 | 6 | 0 | 76 | 378.476 | 7 | ↓ |
