In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2008 | 26 | 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) | 4.39 | 11.17 | -13.24 | 1 | 4 | 0 | 49 | 347.462 | 7 | ↓ |
Popular Name: 4-[5-(2,4-dichlorophenyl)-2H-pyrazol-3-yl]-N-ethyl-N-propyl-benzamide 4-[5-(2,4-dichlorophenyl)-2H-pyr…
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) | 5.17 | 11.64 | -14.54 | 1 | 4 | 0 | 49 | 402.325 | 6 | ↓ |
Popular Name: 4-[5-(2,4-dichlorophenyl)-2H-pyrazol-3-yl]-N,N-dipropyl-benzamide 4-[5-(2,4-dichlorophenyl)-2H-pyr…
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) | 5.67 | 12.34 | -13.85 | 1 | 4 | 0 | 49 | 416.352 | 7 | ↓ |
Popular Name: N-(2-cyanoethyl)-4-[5-(1-naphthyl)-2H-pyrazol-3-yl]benzamide N-(2-cyanoethyl)-4-[5-(1-naphthy…
None
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) | 3.48 | 9.9 | -25.01 | 2 | 5 | 0 | 82 | 366.424 | 5 | ↓ |
Ref Reference (pH 7) | 3.48 | 9.97 | -18.65 | 2 | 5 | 0 | 82 | 366.424 | 5 | ↓ |