In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: 4-bromo-2-chloro-N-[(1S)-2-(diethylamino)-1-methyl-ethyl]benzenesulfonamide 4-bromo-2-chloro-N-[(1S)-2-(diet…
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) | 3.53 | 5.85 | -40.29 | 2 | 4 | 1 | 51 | 384.747 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.53 | 3.75 | -6.34 | 1 | 4 | 0 | 49 | 383.739 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.53 | 6.06 | -28.51 | 1 | 4 | 0 | 53 | 383.739 | 7 | ↓ |