| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | No |
Popular Name: N,N-diisopropyl-N'-[(4S)-isothiochroman-4-yl]ethane-1,2-diamine N,N-diisopropyl-N'-[(4S)-isothio…
| 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) | 3.36 | 7.9 | -41.17 | 2 | 2 | 1 | 20 | 293.5 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 6.49 | -2.26 | 1 | 2 | 0 | 15 | 292.492 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 8.71 | -32.08 | 2 | 2 | 1 | 16 | 293.5 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 9.91 | -119.12 | 3 | 2 | 2 | 21 | 294.508 | 6 | ↓ |
