In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 20 | Yes |
Popular Name: 4-[(1R)-1-(ethylamino)ethyl]-N-isobutyl-N-methyl-benzenesulfonamide 4-[(1R)-1-(ethylamino)ethyl]-N-i…
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) | 2.87 | 5.97 | -47.87 | 2 | 4 | 1 | 54 | 299.46 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 4.86 | -7.71 | 1 | 4 | 0 | 49 | 298.452 | 7 | ↓ |