| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 21 | Yes |
Popular Name: N',N'-dimethyl-N-[4-methyl-1,1-dioxo-5-(p-tolyl)isothiazol-3-yl]ethane-1,2-diamine N',N'-dimethyl-N-[4-methyl-1,1-d…
| 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) | 2.13 | 4.59 | -44.53 | 1 | 5 | 0 | 65 | 307.419 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.13 | 2.89 | -17.81 | 1 | 5 | 0 | 62 | 307.419 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 5.43 | -60.71 | 2 | 5 | 1 | 63 | 308.427 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
