| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 18 | No |
Popular Name: N,N-diethyl-N'-[(4S)-isothiochroman-4-yl]ethane-1,2-diamine N,N-diethyl-N'-[(4S)-isothiochro…
| 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) | 2.77 | 7.23 | -40.25 | 2 | 2 | 1 | 20 | 265.446 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 6.03 | -2.52 | 1 | 2 | 0 | 15 | 264.438 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 8.14 | -34.19 | 2 | 2 | 1 | 16 | 265.446 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.77 | 9.33 | -119.72 | 3 | 2 | 2 | 21 | 266.454 | 6 | ↓ |
