In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2011 | 24 | Yes |
Popular Name: (2R)-1-[4-[[[2-(2-pyridyl)thiazol-4-yl]methylamino]methyl]-1-piperidyl]propan-2-ol (2R)-1-[4-[[[2-(2-pyridyl)thiazo…
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) | 1.97 | 5.66 | -100.85 | 4 | 5 | 2 | 67 | 348.516 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 4.42 | -37.26 | 3 | 5 | 1 | 62 | 347.508 | 7 | ↓ |