In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 35 | Yes |
Popular Name: (2S,3R)-N,N-diisopropyl-3-phenyl-2-(3-pyridyl)-4-[3-(2-pyridyl)propanoylamino]butanamide (2S,3R)-N,N-diisopropyl-3-phenyl…
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) | 3.45 | 12.07 | -13.61 | 1 | 6 | 0 | 75 | 472.633 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.45 | 11.7 | -41.61 | 2 | 6 | 1 | 76 | 473.641 | 11 | ↓ |