In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 20th, 2010 | 18 | Yes |
Popular Name: 2-chloro-4-fluoro-N-[(3S)-1-methylpyrrolidin-3-yl]benzenesulfonamide 2-chloro-4-fluoro-N-[(3S)-1-meth…
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) | 1.93 | 3.86 | -43.13 | 2 | 4 | 1 | 51 | 293.771 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 3.66 | -35.83 | 1 | 4 | 0 | 53 | 292.763 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 1.17 | -7.22 | 1 | 4 | 0 | 49 | 292.763 | 3 | ↓ |