| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | No |
Popular Name: (3S)-3-(4,5-dimethylthiazol-2-yl)-1,1-dioxo-N-propyl-thiolan-3-amine (3S)-3-(4,5-dimethylthiazol-2-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) | 1.27 | 1.55 | -13.1 | 1 | 4 | 0 | 59 | 288.438 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 2.67 | -54.01 | 2 | 4 | 1 | 64 | 289.446 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.27 | 3.36 | -116.48 | 3 | 4 | 2 | 65 | 290.454 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
