| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2007 | 33 | No |
Popular Name: 4-benzoyl-1-[3-(dibutylamino)propyl]-3-hydroxy-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one 4-benzoyl-1-[3-(dibutylamino)pro…
| 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) | 4.32 | 12.22 | -55.46 | 2 | 6 | 1 | 75 | 450.603 | 13 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 12.98 | -68.44 | 1 | 6 | 1 | 72 | 450.603 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 4.76 | 12.3 | -128.43 | 3 | 6 | 2 | 76 | 451.611 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 3.73 | 13.27 | -138.01 | 2 | 6 | 2 | 73 | 451.611 | 13 | ↓ |
