In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 24 | No |
Popular Name: 3-[[(1R)-2-hydroxy-1-(p-tolyl)ethyl]amino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-dione 3-[[(1R)-2-hydroxy-1-(p-tolyl)et…
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) | 0.70 | 2.8 | -61.68 | 3 | 6 | 0 | 93 | 324.36 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 2.27 | -11.97 | 2 | 6 | 0 | 92 | 323.352 | 5 | ↓ |