| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 18 | Yes |
Popular Name: (1S)-N-ethyl-N-(2-ethylbutyl)-1-(3-methyl-2-thienyl)ethane-1,2-diamine (1S)-N-ethyl-N-(2-ethylbutyl)-1-…
| 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) | 3.51 | 6.34 | -47.04 | 3 | 2 | 1 | 31 | 269.478 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.51 | 6.18 | -2.05 | 2 | 2 | 0 | 29 | 268.47 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.51 | 8.06 | -120.84 | 4 | 2 | 2 | 32 | 270.486 | 8 | ↓ |
