| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(3-chlorophenyl)-N-ethyl-2-(3-pyridyl)ethanamine (1S)-1-(3-chlorophenyl)-N-ethyl-…
| 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) | 3.28 | 8.19 | -48.16 | 2 | 2 | 1 | 29 | 261.776 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.28 | 7.27 | -4.68 | 1 | 2 | 0 | 25 | 260.768 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.28 | 8.67 | -102.99 | 3 | 2 | 2 | 31 | 262.784 | 5 | ↓ |
