In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: (2R)-1-amino-3-[ethyl-[[(2R)-tetrahydrofuran-2-yl]methyl]amino]propan-2-ol (2R)-1-amino-3-[ethyl-[[(2R)-tet…
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) | -0.75 | -2.07 | -43.19 | 4 | 4 | 1 | 60 | 203.306 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.75 | -2.52 | -5.55 | 3 | 4 | 0 | 59 | 202.298 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.75 | 0 | -31.38 | 4 | 4 | 1 | 60 | 203.306 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.75 | 0.89 | -41.15 | 4 | 4 | 1 | 64 | 203.306 | 6 | ↓ |