| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2010 | 15 | Yes |
Popular Name: (3S)-N-[(3-chlorophenyl)methyl]-N-methyl-pyrrolidin-3-amine (3S)-N-[(3-chlorophenyl)methyl]-…
| 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) | 2.30 | 5.54 | -37.14 | 2 | 2 | 1 | 16 | 225.743 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 4.7 | -39.07 | 2 | 2 | 1 | 20 | 225.743 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 3.29 | -2.96 | 1 | 2 | 0 | 15 | 224.735 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.30 | 6.96 | -112.62 | 3 | 2 | 2 | 21 | 226.751 | 3 | ↓ |
