In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 17 | Yes |
Popular Name: 5-bromo-N-[(2R)-2-(dimethylamino)propyl]pyridine-3-sulfonamide 5-bromo-N-[(2R)-2-(dimethylamino…
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) | 1.25 | 2.2 | -42.39 | 2 | 5 | 1 | 63 | 323.236 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.25 | 1.74 | -29.59 | 1 | 5 | 0 | 66 | 322.228 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.25 | -0.23 | -7.81 | 1 | 5 | 0 | 62 | 322.228 | 5 | ↓ |