| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2011 | 32 | Yes |
Popular Name: 1-(4-benzylpiperazin-1-yl)-2-(2-isopropyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)ethanone 1-(4-benzylpiperazin-1-yl)-2-(2-…
| 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) | 3.55 | 13.38 | -42.79 | 1 | 5 | 1 | 33 | 431.604 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 15.59 | -100.86 | 2 | 5 | 2 | 34 | 432.612 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 11.02 | -14.65 | 0 | 5 | 0 | 32 | 430.596 | 5 | ↓ |
