| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 22 | Yes |
Popular Name: 2-chloro-4-[[2-hydroxyethyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]phenol 2-chloro-4-[[2-hydroxyethyl-[(4-…
| 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) | 3.33 | 6.16 | -46.3 | 3 | 3 | 1 | 45 | 338.88 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 6.92 | -61.21 | 2 | 3 | 0 | 48 | 337.872 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 5.02 | -45.95 | 1 | 3 | -1 | 47 | 336.864 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 4.25 | -6.51 | 2 | 3 | 0 | 44 | 337.872 | 7 | ↓ |
