In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 31 | Yes |
Popular Name: N-[3-(4-benzyl-1-piperidyl)propyl]-4-methyl-1,1-dioxo-5-phenyl-isothiazol-3-amine N-[3-(4-benzyl-1-piperidyl)propy…
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 | 11.53 | -66.34 | 2 | 5 | 1 | 63 | 438.617 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.53 | 10.56 | -52.87 | 1 | 5 | 0 | 65 | 437.609 | 8 | ↓ |