| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2004 | 24 | Yes |
Popular Name: [(2S)-3-(N-besyl-3-methyl-anilino)-2-hydroxy-propyl]-dimethyl-ammonium [(2S)-3-(N-besyl-3-methyl-anilin…
| 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) | 2.76 | 7.42 | -42.25 | 2 | 5 | 1 | 62 | 349.476 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 5.06 | -12.53 | 1 | 5 | 0 | 61 | 348.468 | 7 | ↓ |
