In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 33 | 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) | 3.62 | 10.32 | -24.7 | 1 | 7 | 0 | 75 | 440.503 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 10.71 | -46.63 | 2 | 7 | 1 | 76 | 441.511 | 6 | ↓ |