| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 19 | Yes |
Popular Name: N-[(2R)-2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]propyl]cyclopentanamine N-[(2R)-2-[(4aR,8aS)-3,4,4a,5,6,…
| 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) | 4.03 | 10.26 | -108.72 | 3 | 2 | 2 | 21 | 266.473 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.03 | 10.06 | -27.91 | 2 | 2 | 1 | 16 | 265.465 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 8.26 | -35.02 | 2 | 2 | 1 | 20 | 265.465 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
