In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 17 | Yes |
Popular Name: 1-[(3S)-3-propyl-3-piperidyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]methanamine 1-[(3S)-3-propyl-3-piperidyl]-N-…
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) | 1.47 | 5.32 | -98.55 | 4 | 3 | 2 | 42 | 242.407 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.25 | -37.8 | 3 | 3 | 1 | 38 | 241.399 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.