In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2010 | 25 | Yes |
Popular Name: 3-(1,3-benzodioxol-5-yl)-N-isobutyl-N-(2-pyridylmethyl)propanamide 3-(1,3-benzodioxol-5-yl)-N-isobu…
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) | 3.23 | 9.28 | -9.54 | 0 | 5 | 0 | 52 | 340.423 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 9.77 | -36.17 | 1 | 5 | 1 | 53 | 341.431 | 7 | ↓ |