In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: 4-[(1S)-1-aminoethyl]-N-[4-(dimethylamino)butyl]benzenesulfonamide 4-[(1S)-1-aminoethyl]-N-[4-(dime…
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) | -0.56 | 3.12 | -101.66 | 5 | 5 | 2 | 78 | 301.456 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.56 | 2.79 | -42.86 | 4 | 5 | 1 | 77 | 300.448 | 8 | ↓ |