In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: (2R)-4-(2-aminoethylamino)-2-isopropyl-2-methyl-4-oxo-butanoic (2R)-4-(2-aminoethylamino)-2-iso…
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) | -0.52 | 1.31 | -76.25 | 4 | 5 | 0 | 97 | 216.281 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.52 | 1.57 | -59.17 | 3 | 5 | -1 | 95 | 215.273 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.52 | -0.45 | -50.16 | 5 | 5 | 1 | 94 | 217.289 | 6 | ↓ |