| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2011 | 21 | Yes |
Popular Name: (1S)-N'-[(1R)-1-ethylpentyl]-1-(3-methoxyphenyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-[(1R)-1-ethylpentyl]-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) | 4.55 | 7.76 | -33.67 | 2 | 3 | 1 | 29 | 293.475 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.55 | 7.9 | -2.22 | 1 | 3 | 0 | 24 | 292.467 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.55 | 9.91 | -113.27 | 3 | 3 | 2 | 30 | 294.483 | 10 | ↓ |
