| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 17 | Yes |
Popular Name: (3S,4R)-N4-ethyl-N3-methyl-N3-[(1R)-1-methylbutyl]heptane-3,4-diamine (3S,4R)-N4-ethyl-N3-methyl-N3-[(…
| 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) | 4.56 | 9.02 | -106.23 | 3 | 2 | 2 | 21 | 244.467 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.56 | 6.99 | -31.74 | 2 | 2 | 1 | 20 | 243.459 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 7.81 | -29.22 | 2 | 2 | 1 | 16 | 243.459 | 10 | ↓ |
