In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 17 | Yes |
Popular Name: (3S,5R)-5-methyl-3-[[(1S,2R)-1-methyl-2-pyrazol-1-yl-propyl]amino]tetrahydrofuran-2-one (3S,5R)-5-methyl-3-[[(1S,2R)-1-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) | -0.19 | 4.71 | -10.46 | 1 | 5 | 0 | 56 | 237.303 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.19 | 5.57 | -48.08 | 2 | 5 | 1 | 61 | 238.311 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.