In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (2S,4S,5S)-1,2,5-trimethyl-N-[2-(3-methylphenoxy)ethyl]piperidin-4-amine (2S,4S,5S)-1,2,5-trimethyl-N-[2-…
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) | 3.43 | 7.63 | -33.41 | 2 | 3 | 1 | 26 | 277.432 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.43 | 8.64 | -100.91 | 3 | 3 | 2 | 30 | 278.44 | 5 | ↓ |