| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: 3-[(5-chloro-2-hydroxy-phenyl)methylamino]-1-pyrrolidin-1-yl-propan-1-one 3-[(5-chloro-2-hydroxy-phenyl)me…
| 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) | 2.12 | 4.79 | -55.23 | 3 | 4 | 1 | 57 | 283.779 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 5.31 | -36.1 | 2 | 4 | 0 | 60 | 282.771 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 3.37 | -10.45 | 2 | 4 | 0 | 53 | 282.771 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 3.89 | -41.48 | 1 | 4 | -1 | 55 | 281.763 | 5 | ↓ |
