| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2006 | 27 | No |
Popular Name: 1-(3-dimethylaminopropyl)-3-hydroxy-5-(3-pyridyl)-4-(4-pyridylcarbonyl)-5H-pyrrol-2-one 1-(3-dimethylaminopropyl)-3-hydr…
| 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) | 0.15 | 6.22 | -55.21 | 2 | 7 | 1 | 88 | 367.429 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.43 | 6.89 | -66.79 | 1 | 7 | 1 | 85 | 367.429 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -0.43 | 7.18 | -117.13 | 2 | 7 | 2 | 86 | 368.437 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.15 | 6.51 | -102.23 | 3 | 7 | 2 | 89 | 368.437 | 7 | ↓ |
