In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 26 | 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) | 5.22 | 12.28 | -41.86 | 2 | 2 | 1 | 29 | 367.944 | 1 | ↓ |
Lo Low (pH 4.5-6) | 5.22 | 12.64 | -98.75 | 3 | 2 | 2 | 31 | 368.952 | 1 | ↓ |