In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 28 | No |
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) | 4.50 | 11.72 | -48.95 | 0 | 4 | -1 | 60 | 388.572 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.50 | 9.74 | -9.46 | 1 | 4 | 0 | 58 | 389.58 | 4 | ↓ |