In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 27 | 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) | 1.11 | 3.99 | -15.44 | 1 | 8 | 0 | 99 | 362.393 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.11 | 4.45 | -53.75 | 2 | 8 | 1 | 100 | 363.401 | 4 | ↓ |