In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2011 | 31 | No |
Popular Name: 3-(hydroxy-methoxycarbonyl-dimethyl-oxo-BLAHyl)propanoic 3-(hydroxy-methoxycarbonyl-dimet…
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) | 2.31 | 7.62 | -51.09 | 1 | 7 | -1 | 116 | 431.505 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 5.64 | -13.41 | 2 | 7 | 0 | 113 | 432.513 | 5 | ↓ |