In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 15 | No |
Popular Name: N-methyl-N-[(5-methylisoxazol-3-yl)methyl]-3-oxo-butanamide N-methyl-N-[(5-methylisoxazol-3-…
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) | -0.18 | 5.59 | -16.98 | 0 | 5 | 0 | 63 | 210.233 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.16 | 4.54 | -48.23 | 0 | 5 | -1 | 69 | 209.225 | 4 | ↓ |