In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2011 | 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) | -0.61 | 5.45 | -46.74 | 2 | 6 | 1 | 63 | 205.245 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.61 | 4.16 | -9.99 | 1 | 6 | 0 | 58 | 204.237 | 1 | ↓ |