In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 35 | 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) | 3.21 | 9.02 | -52.18 | 1 | 9 | 1 | 93 | 519.669 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 6.65 | -14.2 | 0 | 9 | 0 | 92 | 518.661 | 9 | ↓ |