In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: 3-[[methyl-[(1R)-1-methylbutyl]amino]methyl]furan-2-carboxylic 3-[[methyl-[(1R)-1-methylbutyl]a…
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) | 2.27 | 7.86 | -41.9 | 1 | 4 | 0 | 58 | 225.288 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 5.43 | -51.04 | 0 | 4 | -1 | 57 | 224.28 | 6 | ↓ |