| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 16 | No |
Popular Name: N'-[(4S)-isothiochroman-4-yl]-N,N-dimethyl-ethane-1,2-diamine N'-[(4S)-isothiochroman-4-yl]-N,…
| 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) | 2.02 | 5.5 | -39.9 | 2 | 2 | 1 | 20 | 237.392 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 4.3 | -2.87 | 1 | 2 | 0 | 15 | 236.384 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 6.77 | -36.01 | 2 | 2 | 1 | 16 | 237.392 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.02 | 7.96 | -118.85 | 3 | 2 | 2 | 21 | 238.4 | 4 | ↓ |
