In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 20 | Yes |
Popular Name: 6-[(S)-amino-(3-methyl-2-furyl)methyl]-1-methyl-3,4-dihydroquinolin-2-one 6-[(S)-amino-(3-methyl-2-furyl)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) | 1.77 | 5.85 | -54.04 | 3 | 4 | 1 | 61 | 271.34 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 5.53 | -9.87 | 2 | 4 | 0 | 59 | 270.332 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.