In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 21 | Yes |
Popular Name: 3-[(1S)-1-(methylamino)ethyl]-N-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]benzenesulfonamide 3-[(1S)-1-(methylamino)ethyl]-N-…
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) | 1.38 | 3.15 | -50.69 | 3 | 5 | 1 | 72 | 313.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 1.98 | -9.91 | 2 | 5 | 0 | 67 | 312.435 | 7 | ↓ |