In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 36 | No |
Popular Name: 1-[[(2R)-3,3-dimethyloxiran-2-yl]-methyl-BLAHyl]butan-1-one 1-[[(2R)-3,3-dimethyloxiran-2-yl…
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) | 4.67 | 11.55 | -41.52 | 2 | 6 | 1 | 53 | 485.652 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.67 | 9.41 | -9.76 | 1 | 6 | 0 | 51 | 484.644 | 3 | ↓ |