In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 31 | 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) | 2.55 | 4.19 | -15.33 | 4 | 8 | 0 | 126 | 415.453 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 4.47 | -66.33 | 5 | 8 | 1 | 128 | 416.461 | 5 | ↓ |