In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 26 | Yes |
Popular Name: [[(2R)-2-hydroxy-3-prop-2-ynoxy-propyl]-isopropyl-amino]methylBLAHone [[(2R)-2-hydroxy-3-prop-2-ynoxy-…
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) | 1.48 | 6.22 | -55.95 | 3 | 6 | 1 | 80 | 376.502 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 3.58 | -53.3 | 2 | 6 | 0 | 83 | 375.494 | 8 | ↓ |