In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 14 | No |
Popular Name: (3R)-3-(2-chloroethyl)-1-[(3R)-tetrahydrofuran-3-yl]piperidine (3R)-3-(2-chloroethyl)-1-[(3R)-t…
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) | 2.10 | 6.54 | -36.55 | 1 | 2 | 1 | 14 | 218.748 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.10 | 4.35 | -3.17 | 0 | 2 | 0 | 12 | 217.74 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.