| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-1-(4-chlorophenyl)-N1-ethyl-N1-[(1S)-2-methoxy-1-methyl-ethyl]butane-1,2-diamine (1R,2S)-1-(4-chlorophenyl)-N1-et…
| 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) | 3.03 | 6.45 | -114.11 | 4 | 3 | 2 | 41 | 300.874 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 4.74 | -45.67 | 3 | 3 | 1 | 40 | 299.866 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 6.17 | -31.56 | 3 | 3 | 1 | 40 | 299.866 | 8 | ↓ |
