In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | Yes |
Popular Name: 3-[[methyl-[(1R)-1,2,2-trimethylpropyl]amino]methyl]furan-2-carboxylic 3-[[methyl-[(1R)-1,2,2-trimethyl…
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) | 2.53 | 7.88 | -41.88 | 1 | 4 | 0 | 58 | 239.315 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 6.3 | -48.94 | 0 | 4 | -1 | 57 | 238.307 | 5 | ↓ |