In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 12th, 2014 | 25 | Yes |
Popular Name: 3-[[cyclopentyl(2-furylmethyl)amino]methyl]-1-methyl-quinoxalin-2-one 3-[[cyclopentyl(2-furylmethyl)am…
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) | 3.35 | 10.23 | -30.74 | 1 | 5 | 1 | 52 | 338.431 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 8.27 | -9.9 | 0 | 5 | 0 | 51 | 337.423 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.