| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-1-(4-ethylphenyl)-N2-isopentyl-N1,N2-dimethyl-propane-1,2-diamine (1S,2S)-1-(4-ethylphenyl)-N2-iso…
| 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) | 4.61 | 10.75 | -109.96 | 3 | 2 | 2 | 21 | 278.484 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.61 | 9.95 | -32.29 | 2 | 2 | 1 | 16 | 277.476 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.61 | 9.01 | -33.9 | 2 | 2 | 1 | 20 | 277.476 | 8 | ↓ |
