In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: N-[(2R,4aR,8aR)-decalin-2-yl]-1-methyl-piperidin-4-amine N-[(2R,4aR,8aR)-decalin-2-yl]-1-…
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) | 3.33 | 6.79 | -37.34 | 2 | 2 | 1 | 20 | 251.438 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 9.18 | -103.71 | 3 | 2 | 2 | 21 | 252.446 | 2 | ↓ |