| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 22nd, 2010 | 21 | Yes |
Popular Name: (2S)-2-(aminomethyl)-1-(4-cyclopropylpiperazin-1-yl)-3-phenyl-propan-1-one (2S)-2-(aminomethyl)-1-(4-cyclop…
| 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) | 0.90 | 4.94 | -41.81 | 3 | 4 | 1 | 51 | 288.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 4.53 | -7.78 | 2 | 4 | 0 | 50 | 287.407 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 7.14 | -100.2 | 4 | 4 | 2 | 52 | 289.423 | 5 | ↓ |
