In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 26 | Yes |
Popular Name: N-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-N-isopropyl-2-methyl-propanamide N-[3-(4-benzylpiperazin-1-yl)-3-…
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) | 2.37 | 8.58 | -13.82 | 0 | 5 | 0 | 44 | 359.514 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 10.79 | -52.43 | 1 | 5 | 1 | 45 | 360.522 | 7 | ↓ |