In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 19 | 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) | 1.87 | 4.16 | -48.22 | 4 | 4 | 1 | 63 | 262.377 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 4.79 | -100.31 | 5 | 4 | 2 | 64 | 263.385 | 5 | ↓ |