In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 26 | Yes |
Popular Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-[(2R)-2-(o-tolyl)pyrrolidin-1-yl]ethanone 1-[4-(cyclopropanecarbonyl)piper…
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) | 2.16 | 10.76 | -41.76 | 1 | 5 | 1 | 45 | 356.49 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.16 | 9.33 | -12.19 | 0 | 5 | 0 | 44 | 355.482 | 4 | ↓ |