| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 20 | No |
Popular Name: (4-isopropylpiperazin-1-yl)-(1-methylsulfonyl-2,5-dihydropyrrol-3-yl)methanone (4-isopropylpiperazin-1-yl)-(1-m…
| 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) | -0.05 | 2.71 | -49.09 | 1 | 6 | 1 | 62 | 302.42 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 0.47 | -14.1 | 0 | 6 | 0 | 61 | 301.412 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
