In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 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) | 2.79 | 4.98 | -66.81 | 3 | 8 | -1 | 131 | 437.472 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 4.21 | -24.26 | 4 | 8 | 0 | 128 | 438.48 | 10 | ↓ |