| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 17 | Yes |
Popular Name: (2R,3S)-2-amino-1-(4-isopropylpiperazin-1-yl)-3-methyl-pentan-1-one (2R,3S)-2-amino-1-(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) | 0.72 | 2.51 | -42.19 | 3 | 4 | 1 | 51 | 242.387 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 2.2 | -5.2 | 2 | 4 | 0 | 50 | 241.379 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 4.65 | -97.9 | 4 | 4 | 2 | 52 | 243.395 | 4 | ↓ |
