| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 19 | Yes |
Popular Name: (3S,4R)-N-ethyl-3-(4-isopropylpiperazin-1-yl)heptan-4-amine (3S,4R)-N-ethyl-3-(4-isopropylpi…
| 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) | 3.36 | 7.47 | -87.71 | 3 | 3 | 2 | 24 | 271.493 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 5.27 | -33.6 | 2 | 3 | 1 | 23 | 270.485 | 8 | ↓ |
