In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 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) | 4.50 | 13.86 | -41.94 | 1 | 5 | 1 | 48 | 434.511 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.50 | 11.65 | -9.91 | 0 | 5 | 0 | 47 | 433.503 | 7 | ↓ |