In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 17 | Yes |
Popular Name: (2R,4S)-N-ethyl-2-methyl-1-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]piperidin-4-amine (2R,4S)-N-ethyl-2-methyl-1-[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) | 1.50 | 4.27 | -36.37 | 2 | 3 | 1 | 29 | 241.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 5.24 | -31.69 | 2 | 3 | 1 | 26 | 241.399 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 6.39 | -98.98 | 3 | 3 | 2 | 30 | 242.407 | 5 | ↓ |