In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | 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) | 1.71 | 1.93 | -9.99 | 3 | 5 | 0 | 71 | 270.288 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.71 | 2.24 | -40.82 | 4 | 5 | 1 | 75 | 271.296 | 3 | ↓ |