In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 22 | No |
Popular Name: 4-[[4-(cyanomethyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoic 4-[[4-(cyanomethyl)-3-oxo-1,4-be…
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) | -0.04 | 3.6 | -57.78 | 1 | 8 | -1 | 123 | 302.266 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.04 | 2.48 | -22.25 | 2 | 8 | 0 | 120 | 303.274 | 5 | ↓ |