In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 28 | Yes |
None
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) | 3.20 | 11.18 | -15.93 | 1 | 7 | 0 | 71 | 381.48 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.20 | 11.6 | -33.87 | 2 | 7 | 1 | 72 | 382.488 | 6 | ↓ |