In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 20 | Yes |
Popular Name: 3-[(1S)-1-aminoethyl]-N-[2-[(2R)-tetrahydrofuran-2-yl]ethyl]benzenesulfonamide 3-[(1S)-1-aminoethyl]-N-[2-[(2R)…
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) | -0.87 | 1.36 | -53.65 | 4 | 5 | 1 | 83 | 299.416 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.87 | 1.03 | -9.85 | 3 | 5 | 0 | 81 | 298.408 | 6 | ↓ |