In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 21 | Yes |
Popular Name: 2,2-diethyl-4-[4-[isopropyl(methyl)amino]butylamino]-4-oxo-butanoic 2,2-diethyl-4-[4-[isopropyl(meth…
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) | 2.01 | 8.9 | -75.11 | 2 | 5 | 0 | 74 | 300.443 | 11 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 6.3 | -38.63 | 3 | 5 | 1 | 71 | 301.451 | 11 | ↓ |