| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 21 | Yes |
Popular Name: (2S)-3-ethyl-N-[(4-isopropylphenyl)methyl]-N',N'-dimethyl-pentane-1,2-diamine (2S)-3-ethyl-N-[(4-isopropylphen…
| 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) | 5.15 | 9.26 | -38.15 | 2 | 2 | 1 | 20 | 291.503 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.15 | 9.88 | -33.69 | 2 | 2 | 1 | 16 | 291.503 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 5.15 | 11.28 | -124.65 | 3 | 2 | 2 | 21 | 292.511 | 9 | ↓ |
