| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | No |
Popular Name: 4-[[2-dimethylaminoethyl(propyl)amino]methyl]-3-fluoro-benzenecarbothioamide 4-[[2-dimethylaminoethyl(propyl)…
| 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) | 2.54 | 9.09 | -118.35 | 4 | 3 | 2 | 35 | 299.459 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 6.63 | -46.05 | 3 | 3 | 1 | 34 | 298.451 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 4.48 | -10.13 | 2 | 3 | 0 | 32 | 297.443 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 6.95 | -42.67 | 3 | 3 | 1 | 34 | 298.451 | 8 | ↓ |
