In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | 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) | 0.12 | 6.43 | -18.15 | 0 | 5 | 0 | 54 | 253.327 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.12 | 6.87 | -44.56 | 1 | 5 | 1 | 55 | 254.335 | 3 | ↓ |