In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2009 | 18 | Yes |
Popular Name: 4-[isopropyl-[(1R)-1-methyl-2-oxo-2-(prop-2-ynylamino)ethyl]amino]butanoic 4-[isopropyl-[(1R)-1-methyl-2-ox…
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) | 0.40 | 6.11 | -53.25 | 2 | 5 | 0 | 74 | 254.33 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.58 | 3.66 | -60.03 | 1 | 5 | -1 | 80 | 253.322 | 8 | ↓ |