| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 19 | No |
Popular Name: 2-chloro-6-[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]benzenecarbothioamide 2-chloro-6-[[(2S)-1-ethylpyrroli…
| 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) | 2.97 | 6.47 | -45.16 | 4 | 3 | 1 | 42 | 298.863 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.97 | 4.14 | -10.67 | 3 | 3 | 0 | 41 | 297.855 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
