In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 20 | Yes |
Popular Name: N-[(1S)-1,3-dimethylbutyl]-4-[(1S)-1-(methylamino)ethyl]benzenesulfonamide N-[(1S)-1,3-dimethylbutyl]-4-[(1…
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) | 3.11 | 4.69 | -50.31 | 3 | 4 | 1 | 63 | 299.46 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 3.51 | -7.55 | 2 | 4 | 0 | 58 | 298.452 | 7 | ↓ |