In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 24 | Yes |
Popular Name: 5-(3,4-dimethylphenyl)-3-[(3S,5S)-3,5-dimethyl-1-piperidyl]-4-methyl-isothiazole 5-(3,4-dimethylphenyl)-3-[(3S,5S…
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) | 4.34 | 8.31 | -20.66 | 0 | 4 | 0 | 50 | 346.496 | 2 | ↓ |