| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2010 | 18 | Yes |
Popular Name: (1S)-N-cyclohexyl-1-(5-ethyl-2-thienyl)-N-methyl-ethane-1,2-diamine (1S)-N-cyclohexyl-1-(5-ethyl-2-t…
| 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) | 3.33 | 8.02 | -121.33 | 4 | 2 | 2 | 32 | 268.47 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 5.88 | -43.28 | 3 | 2 | 1 | 31 | 267.462 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 5.66 | -1.59 | 2 | 2 | 0 | 29 | 266.454 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 7.88 | -27.92 | 3 | 2 | 1 | 30 | 267.462 | 5 | ↓ |
