In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 19 | Yes |
Popular Name: (2R,4R,5R)-N-[(1S)-1-(3-chlorophenyl)ethyl]-1,2,5-trimethyl-piperidin-4-amine (2R,4R,5R)-N-[(1S)-1-(3-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) | 3.94 | 9.37 | -103.53 | 3 | 2 | 2 | 21 | 282.859 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 8.68 | -35.56 | 2 | 2 | 1 | 16 | 281.851 | 3 | ↓ |