In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 28 | Yes |
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) | -0.03 | 7.29 | -27.84 | 1 | 9 | 0 | 104 | 384.44 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.03 | 7.42 | -48.53 | 2 | 9 | 1 | 105 | 385.448 | 6 | ↓ |