| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2010 | 20 | Yes |
Popular Name: (1S)-N-benzyl-N-ethyl-1-(5-ethyl-2-thienyl)ethane-1,2-diamine (1S)-N-benzyl-N-ethyl-1-(5-ethyl…
| 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) | 3.20 | 9.04 | -127.17 | 4 | 2 | 2 | 32 | 290.476 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 8.68 | -28.36 | 3 | 2 | 1 | 30 | 289.468 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 6.98 | -2.48 | 2 | 2 | 0 | 29 | 288.46 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 7.39 | -47.35 | 3 | 2 | 1 | 31 | 289.468 | 7 | ↓ |
