| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 19 | Yes |
Popular Name: (3S,4R)-N4-ethyl-N3,N3-bis(2-methoxyethyl)heptane-3,4-diamine (3S,4R)-N4-ethyl-N3,N3-bis(2-met…
| 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) | 2.76 | 6.27 | -35.69 | 2 | 4 | 1 | 38 | 275.457 | 13 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 3.44 | -2.54 | 1 | 4 | 0 | 34 | 274.449 | 13 | ↓ |
| Mid Mid (pH 6-8) | 2.76 | 4.82 | -28.93 | 2 | 4 | 1 | 35 | 275.457 | 13 | ↓ |
