In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 20 | Yes |
Popular Name: 2-[[(3R)-3-propyl-3-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline 2-[[(3R)-3-propyl-3-piperidyl]me…
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) | 3.08 | 8.15 | -39.41 | 2 | 2 | 1 | 20 | 273.444 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 10 | -115.89 | 3 | 2 | 2 | 21 | 274.452 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.