In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 27 | Yes |
Popular Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-1-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-yl]ethanone 2-[(5S,7R)-3-hydroxy-1-adamantyl…
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) | 1.92 | 4.83 | -10.34 | 1 | 5 | 0 | 57 | 389.565 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 7.16 | -44.8 | 2 | 5 | 1 | 58 | 390.573 | 4 | ↓ |