| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 19 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(2,4,5-trimethylphenyl)methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(2,4,5-tr…
| 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) | 3.81 | 8.83 | -33.21 | 2 | 2 | 1 | 20 | 263.449 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 9.5 | -33.18 | 2 | 2 | 1 | 16 | 263.449 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.81 | 10.58 | -112.2 | 3 | 2 | 2 | 21 | 264.457 | 7 | ↓ |
