| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | No |
Popular Name: (3R)-N-methyl-1,1-dioxo-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiolan-3-amine (3R)-N-methyl-1,1-dioxo-3-(4,5,6…
| 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) | 1.18 | 0.91 | -11.49 | 1 | 4 | 0 | 59 | 286.422 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 2.15 | -49.13 | 2 | 4 | 1 | 64 | 287.43 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 3.05 | -113.61 | 3 | 4 | 2 | 65 | 288.438 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 1.83 | -35.01 | 2 | 4 | 1 | 60 | 287.43 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
