In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2011 | 21 | Yes |
Popular Name: 7-chloro-5-methyl-4-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl]quinoline 7-chloro-5-methyl-4-[(1R,5S)-8-m…
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) | 3.97 | 9.51 | -44.06 | 1 | 2 | 1 | 17 | 299.825 | 1 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 7.12 | -5.1 | 0 | 2 | 0 | 16 | 298.817 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.