In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 17 | Yes |
Popular Name: (1R,5S)-N-methyl-8-[(1R)-1-(3-thienyl)ethyl]-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-N-methyl-8-[(1R)-1-(3-th…
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) | 2.44 | 5.31 | -38.68 | 2 | 2 | 1 | 20 | 251.419 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 7.38 | -101.08 | 3 | 2 | 2 | 21 | 252.427 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.