| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 21 | Yes |
Popular Name: [2-(4-tert-butylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine [2-(4-tert-butylpiperazin-1-yl)-…
| 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) | 2.23 | 7.89 | -186.84 | 5 | 4 | 3 | 49 | 291.463 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 5.41 | -47.38 | 3 | 4 | 1 | 47 | 289.447 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 5.84 | -99.22 | 4 | 4 | 2 | 48 | 290.455 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 7.47 | -103.1 | 4 | 4 | 2 | 48 | 290.455 | 3 | ↓ |
