In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 23 | No |
Popular Name: methylBLAHdione methylBLAHdione
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) | 2.75 | -2.95 | -10.39 | 2 | 5 | 0 | 78 | 301.305 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | -2.85 | -42.6 | 3 | 5 | 1 | 79 | 302.313 | 0 | ↓ |