| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2008 | 28 | Yes |
Popular Name: (2S)-1-[3-[(benzylamino)methyl]phenoxy]-3-(4-ethylpiperazin-1-yl)propan-2-ol (2S)-1-[3-[(benzylamino)methyl]p…
| 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) | 2.58 | 7.78 | -86.67 | 4 | 5 | 2 | 54 | 385.552 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 4.05 | -6.96 | 2 | 5 | 0 | 48 | 383.536 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 5.47 | -47.63 | 3 | 5 | 1 | 53 | 384.544 | 10 | ↓ |
