In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 18 | Yes |
Popular Name: (2R)-3-[4-[(cyclopropylamino)methyl]-1-piperidyl]-1,1,1-trifluoro-propan-2-ol (2R)-3-[4-[(cyclopropylamino)met…
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) | 1.55 | 4.77 | -100.61 | 4 | 3 | 2 | 41 | 268.323 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.55 | 5.26 | -73.43 | 3 | 3 | 1 | 44 | 267.315 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.