In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | No |
Popular Name: N-methyl-N-[(1R)-1-(5-methyl-2-thienyl)ethyl]-3-oxo-butanamide N-methyl-N-[(1R)-1-(5-methyl-2-t…
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) | 1.56 | 8.11 | -16.81 | 0 | 3 | 0 | 37 | 239.34 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.57 | 7.07 | -51.08 | 0 | 3 | -1 | 43 | 238.332 | 4 | ↓ |