In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2011 | 18 | 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) | 1.82 | 9.4 | -99.45 | 0 | 5 | -2 | 97 | 256.298 | 11 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 7.42 | -53.93 | 1 | 5 | -1 | 94 | 257.306 | 11 | ↓ |