In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 15 | Yes |
Popular Name: 1-[(3R)-3-[(1S)-1-aminoethyl]-1-piperidyl]-2-cyclopropyl-ethanone 1-[(3R)-3-[(1S)-1-aminoethyl]-1-…
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) | 0.78 | 4.52 | -42.04 | 3 | 3 | 1 | 48 | 211.329 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.