| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 21 | No |
Popular Name: 4-[[2-dimethylaminoethyl(isobutyl)amino]methyl]-3-fluoro-benzenecarbothioamide 4-[[2-dimethylaminoethyl(isobuty…
| 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) | 2.78 | 9.56 | -124.38 | 4 | 3 | 2 | 35 | 313.486 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 5.5 | -10.09 | 2 | 3 | 0 | 32 | 311.47 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 7.27 | -45.65 | 3 | 3 | 1 | 34 | 312.478 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 7.98 | -46.08 | 3 | 3 | 1 | 34 | 312.478 | 8 | ↓ |
