In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 19th, 2006 | 20 | 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) | 2.75 | 6.22 | -11.7 | 0 | 4 | 0 | 48 | 263.3 | 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) | 2.69 | 4.64 | -10.63 | 1 | 4 | 0 | 59 | 249.273 | 2 | ↓ |
Popular Name: 3-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)propanenitrile 3-(3-oxo-5,6-diphenyl-1,2,4-tria…
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) | 2.21 | 7.6 | -12.97 | 0 | 5 | 0 | 72 | 302.337 | 4 | ↓ |
Popular Name: 3-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)propanamide 3-(3-oxo-5,6-diphenyl-1,2,4-tria…
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) | 1.76 | 3.89 | -15.05 | 2 | 6 | 0 | 91 | 320.352 | 5 | ↓ |