| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: (2S,3R)-2-amino-1-[4-(cyclopropylmethyl)piperazin-1-yl]-3-methyl-pentan-1-one (2S,3R)-2-amino-1-[4-(cyclopropy…
| 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) | 0.91 | 3.45 | -42.59 | 3 | 4 | 1 | 51 | 254.398 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.91 | 3.16 | -5.24 | 2 | 4 | 0 | 50 | 253.39 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 5.66 | -99.93 | 4 | 4 | 2 | 52 | 255.406 | 5 | ↓ |
