| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | Yes |
Popular Name: (3S,4S)-N3-(2-methoxyethyl)-N3-[(1S)-2-methoxy-1-methyl-ethyl]-N4-propyl-heptane-3,4-diamine (3S,4S)-N3-(2-methoxyethyl)-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) | 3.60 | 7.81 | -37.5 | 2 | 4 | 1 | 38 | 303.511 | 14 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 4.86 | -1.32 | 1 | 4 | 0 | 34 | 302.503 | 14 | ↓ |
| Mid Mid (pH 6-8) | 3.60 | 6.38 | -27.01 | 2 | 4 | 1 | 35 | 303.511 | 14 | ↓ |
