| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 19 | Yes |
Popular Name: (1R,2S)-3-(azocan-1-yl)-2-methyl-1-phenyl-propan-1-amine (1R,2S)-3-(azocan-1-yl)-2-methyl…
| 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) | 2.12 | 8.66 | -31.35 | 3 | 2 | 1 | 30 | 261.433 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 8.98 | -118.78 | 4 | 2 | 2 | 32 | 262.441 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
