In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 14th, 2007 | 32 | Yes |
Popular Name: (4-isopropylphenyl)-methyl-(6-methyl-2-pyridyl)-BLAHdione (4-isopropylphenyl)-methyl-(6-me…
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) | 5.62 | 14.44 | -14.61 | 0 | 5 | 0 | 63 | 424.5 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.62 | 3.36 | -30.09 | 1 | 5 | 1 | 64 | 425.508 | 3 | ↓ |