In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | Yes |
Popular Name: (4S,5S)-4-amino-1-ethyl-5-(5-methyl-2-furyl)pyrrolidin-2-one (4S,5S)-4-amino-1-ethyl-5-(5-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) | 0.10 | 3.22 | -57.58 | 3 | 4 | 1 | 61 | 209.269 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 2.94 | -10 | 2 | 4 | 0 | 59 | 208.261 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.