| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 16 | Yes |
Popular Name: (1R)-N-butyl-N-ethyl-1-(3-methyl-2-thienyl)ethane-1,2-diamine (1R)-N-butyl-N-ethyl-1-(3-methyl…
| 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) | 2.82 | 4.99 | -48.33 | 3 | 2 | 1 | 31 | 241.424 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 6.13 | -28.44 | 3 | 2 | 1 | 30 | 241.424 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.82 | 7.09 | -121.27 | 4 | 2 | 2 | 32 | 242.432 | 7 | ↓ |
