In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 29 | 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) | 1.76 | 10.8 | -78.27 | 1 | 6 | 0 | 78 | 391.471 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 9.91 | -52.75 | 2 | 6 | 1 | 75 | 392.479 | 8 | ↓ |