In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 21 | Yes |
Popular Name: 4-[(1R)-1-aminoethyl]-N-[(1S)-2-(diethylamino)-1-methyl-ethyl]benzenesulfonamide 4-[(1R)-1-aminoethyl]-N-[(1S)-2-…
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) | -0.02 | 3.32 | -106.28 | 5 | 5 | 2 | 78 | 315.483 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.02 | 1.76 | -54.62 | 4 | 5 | 1 | 77 | 314.475 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.02 | 3.04 | -41.57 | 4 | 5 | 1 | 77 | 314.475 | 8 | ↓ |