In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 20 | Yes |
Popular Name: N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]-2-[(2R)-pyrrolidin-2-yl]acetamide N-[2-methyl-2-(4-methylpiperazin…
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) | 1.82 | 3.44 | -85.07 | 4 | 5 | 2 | 53 | 284.448 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 1.31 | -33.26 | 3 | 5 | 1 | 52 | 283.44 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 3.65 | -79.59 | 4 | 5 | 2 | 53 | 284.448 | 5 | ↓ |