In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 31 | Yes |
Popular Name: N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-4-methyl-1,1-dioxo-5-(p-tolyl)isothiazol-3-amine N-[3-(4-cyclohexylpiperazin-1-yl…
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) | 4.19 | 8.5 | -55.82 | 2 | 6 | 1 | 66 | 445.653 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.19 | 6.22 | -19.97 | 1 | 6 | 0 | 65 | 444.645 | 7 | ↓ |