| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 20 | Yes |
Popular Name: 2-chloro-4-[[[(1S)-1-(4-methylsulfanylphenyl)ethyl]amino]methyl]phenol 2-chloro-4-[[[(1S)-1-(4-methylsu…
| 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) | 4.27 | 7.6 | -49.68 | 3 | 2 | 1 | 37 | 308.854 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 6.48 | -5.69 | 2 | 2 | 0 | 32 | 307.846 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 8.37 | -62.42 | 2 | 2 | 0 | 40 | 307.846 | 5 | ↓ |
