In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 32 | 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) | 0.64 | 1.32 | -65.63 | 2 | 9 | -1 | 129 | 440.428 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.64 | 0.57 | -19.74 | 3 | 9 | 0 | 126 | 441.436 | 8 | ↓ |