In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2008 | 30 | 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) | 1.16 | 7.82 | -25.07 | 1 | 7 | 0 | 76 | 408.481 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 8.27 | -59.53 | 2 | 7 | 1 | 77 | 409.489 | 7 | ↓ |