In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 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) | 5.14 | 14.1 | -17.08 | 1 | 6 | 0 | 67 | 466.585 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.14 | 14.43 | -37.73 | 2 | 6 | 1 | 68 | 467.593 | 5 | ↓ |
Popular Name: N-[1-[1-(indolin-1-ylcarbonylmethyl)benzoimidazol-2-yl]ethyl]-4-methyl-benzamide N-[1-[1-(indolin-1-ylcarbonylmet…
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) | 4.24 | 12.66 | -16.77 | 1 | 6 | 0 | 67 | 438.531 | 5 | ↓ |
Popular Name: N-[1-[1-(indolin-1-ylcarbonylmethyl)benzoimidazol-2-yl]ethyl]-4-methyl-benzamide N-[1-[1-(indolin-1-ylcarbonylmet…
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) | 4.24 | -0.5 | -15.02 | 1 | 6 | 0 | 67 | 438.531 | 5 | ↓ |
Popular Name: N-[1-[1-(indolin-1-ylcarbonylmethyl)benzoimidazol-2-yl]ethyl]benzamide N-[1-[1-(indolin-1-ylcarbonylmet…
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) | 3.79 | -0.84 | -16.9 | 1 | 6 | 0 | 67 | 424.504 | 5 | ↓ |
Popular Name: N-[1-[1-(indolin-1-ylcarbonylmethyl)benzoimidazol-2-yl]ethyl]benzamide N-[1-[1-(indolin-1-ylcarbonylmet…
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) | 3.79 | -0.82 | -15.16 | 1 | 6 | 0 | 67 | 424.504 | 5 | ↓ |
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) | 4.34 | -0.24 | -15.72 | 2 | 6 | 0 | 76 | 454.574 | 7 | ↓ |
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) | 4.34 | -0.18 | -15.62 | 2 | 6 | 0 | 76 | 454.574 | 7 | ↓ |
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) | 4.84 | 13.61 | -17.48 | 2 | 6 | 0 | 76 | 486.641 | 10 | ↓ |
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) | 4.84 | -1.21 | -16.8 | 2 | 6 | 0 | 76 | 486.641 | 10 | ↓ |
Popular Name: N-[(1S)-1-[1-[2-[(4-isopropylphenyl)amino]-2-oxo-ethyl]benzimidazol-2-yl]butyl]benzamide N-[(1S)-1-[1-[2-[(4-isopropylphe…
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) | 6.13 | 13.39 | -15.89 | 2 | 6 | 0 | 76 | 468.601 | 9 | ↓ |