In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 29 | No |
Popular Name: 3-chloro-N-[(1R)-1-[4-[(E)-cinnamyl]piperazine-1-carbonyl]butyl]-2,2-dimethyl-propanamide 3-chloro-N-[(1R)-1-[4-[(E)-cinna…
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) | 4.53 | 9.29 | -7.03 | 1 | 5 | 0 | 53 | 419.997 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 11.53 | -50.25 | 2 | 5 | 1 | 54 | 421.005 | 9 | ↓ |