In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2006 | 15 | 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) | 0.76 | 3.71 | -15.13 | 1 | 6 | 0 | 75 | 205.221 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.21 | 1.69 | -53.17 | 0 | 6 | -1 | 78 | 204.213 | 1 | ↓ |