In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (2R,4S,5R)-N-[(1R)-1-(4-chlorophenyl)-2-methyl-propyl]-1,2,5-trimethyl-piperidin-4-amine (2R,4S,5R)-N-[(1R)-1-(4-chloroph…
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) | 4.71 | 11.11 | -102.52 | 3 | 2 | 2 | 21 | 310.913 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.71 | 10.09 | -34.13 | 2 | 2 | 1 | 16 | 309.905 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.71 | 9.08 | -38.91 | 2 | 2 | 1 | 20 | 309.905 | 4 | ↓ |