| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 17 | No |
Popular Name: 2-chloro-6-[[(3S)-1-methylpyrrolidin-3-yl]amino]benzenecarbothioamide 2-chloro-6-[[(3S)-1-methylpyrrol…
| 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) | 2.99 | 5.51 | -46.68 | 4 | 3 | 1 | 42 | 270.809 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 2.81 | -10.87 | 3 | 3 | 0 | 41 | 269.801 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
