In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 37 | 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) | 2.20 | 5.33 | -58.17 | 1 | 10 | -1 | 127 | 514.551 | 14 | ↓ |
Lo Low (pH 4.5-6) | 2.20 | 4.58 | -15.97 | 2 | 10 | 0 | 124 | 515.559 | 14 | ↓ |