| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 19 | No |
Popular Name: 3-chloro-4-[[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]amino]benzenecarbothioamide 3-chloro-4-[[(1R,8R)-2,3,5,6,7,8…
| 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) | 3.41 | 6.79 | -47.31 | 4 | 3 | 1 | 42 | 296.847 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 4.36 | -10.17 | 3 | 3 | 0 | 41 | 295.839 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
