In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 19 | Yes |
Popular Name: 1-methyl-6-[(2S)-pyrrolidine-2-carbonyl]-3,4-dihydroquinolin-2-one 1-methyl-6-[(2S)-pyrrolidine-2-c…
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) | 0.88 | 6.09 | -45.9 | 2 | 4 | 1 | 54 | 259.329 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 4.9 | -12.17 | 1 | 4 | 0 | 49 | 258.321 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.