In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 17 | Yes |
Popular Name: 1-[(2S)-2-amino-2-cyclopropyl-ethyl]-3,4-dihydroquinolin-2-one 1-[(2S)-2-amino-2-cyclopropyl-et…
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) | 0.94 | 6.48 | -33.6 | 3 | 3 | 1 | 48 | 231.319 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 6.12 | -5.5 | 2 | 3 | 0 | 46 | 230.311 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.