In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 25 | Yes |
Popular Name: 4-(3-keto-6-methyl-1,4-benzoxazin-4-yl)-N-(3-pyridylmethyl)butyramide 4-(3-keto-6-methyl-1,4-benzoxazi…
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) | 1.47 | 6.22 | -16.11 | 1 | 6 | 0 | 72 | 339.395 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 6.69 | -48.44 | 2 | 6 | 1 | 73 | 340.403 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 4.27 | -37.91 | 2 | 6 | 1 | 76 | 340.403 | 6 | ↓ |