In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2011 | 21 | Yes |
Popular Name: (3R)-1-(7-chloro-4-quinolyl)-3-methyl-piperidine-3-carboxylic (3R)-1-(7-chloro-4-quinolyl)-3-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) | 3.19 | 9.99 | -60.65 | 1 | 4 | 0 | 58 | 304.777 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.19 | 9.57 | -45.64 | 0 | 4 | -1 | 56 | 303.769 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.