| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: (3S)-3-amino-4-(4-isobutylpiperazin-1-yl)-4-oxo-butanamide (3S)-3-amino-4-(4-isobutylpipera…
| 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) | -0.23 | -1.44 | -38.31 | 5 | 6 | 1 | 94 | 257.358 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.23 | -1.78 | -10.17 | 4 | 6 | 0 | 93 | 256.35 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.23 | 0.49 | -98.53 | 6 | 6 | 2 | 95 | 258.366 | 5 | ↓ |
