| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 17 | Yes |
Popular Name: (4R)-1-[(1S)-1-(cyclopropylmethyl)propyl]-4-ethyl-1,5-diazocane (4R)-1-[(1S)-1-(cyclopropylmethy…
| 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) | 3.40 | 8.43 | -100.8 | 3 | 2 | 2 | 21 | 240.435 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 7.52 | -33.62 | 2 | 2 | 1 | 20 | 239.427 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
