| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 23 | No |
Popular Name: (3S)-1-(2-amino-2-oxo-ethyl)-N-(2,1,3-benzothiadiazol-7-ylmethyl)piperidine-3-carboxamide (3S)-1-(2-amino-2-oxo-ethyl)-N-(…
| 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) | 0.40 | 1.69 | -42.93 | 4 | 7 | 1 | 102 | 334.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | -0.49 | -15.37 | 3 | 7 | 0 | 101 | 333.417 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
