In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2009 | 25 | Yes |
Popular Name: N-[3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-oxo-propyl]-2,2-dimethyl-propanamide N-[3-[4-[(3-chlorophenyl)methyl]…
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) | 3.02 | 6.4 | -21.34 | 1 | 5 | 0 | 53 | 365.905 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 8.73 | -67.14 | 2 | 5 | 1 | 54 | 366.913 | 6 | ↓ |