In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-1-[[(1R)-1-(4-pyridyl)ethyl]amino]-3-[[(2S)-tetrahydrofuran-2-yl]methoxy]propan-2-ol (2S)-1-[[(1R)-1-(4-pyridyl)ethyl…
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) | 0.48 | 2.44 | -48.15 | 3 | 5 | 1 | 68 | 281.376 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 1.35 | -10.27 | 2 | 5 | 0 | 64 | 280.368 | 8 | ↓ |