| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 21 | No |
Popular Name: 2-(4-isopropylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-(4-isopropylpiperazin-1-yl)-6,…
| 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) | 2.33 | 8.4 | -29.22 | 3 | 4 | 1 | 47 | 305.471 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 6.25 | -11.43 | 2 | 4 | 0 | 45 | 304.463 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 8.82 | -83.46 | 4 | 4 | 2 | 48 | 306.479 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 6.68 | -32.72 | 3 | 4 | 1 | 47 | 305.471 | 3 | ↓ |
