In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 23 | Yes |
Popular Name: (3R)-3-amino-1-[(2-hydroxy-6-methoxy-3-quinolyl)methyl]pyrrolidine-3-carboxylic (3R)-3-amino-1-[(2-hydroxy-6-met…
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) | -2.21 | 3.73 | -76.85 | 5 | 7 | 1 | 114 | 318.353 | 4 | ↓ |
Mid Mid (pH 6-8) | -2.21 | 1.23 | -38.44 | 4 | 7 | 0 | 113 | 317.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.