In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | 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) | 4.39 | 11.12 | -36.23 | 2 | 1 | 1 | 17 | 264.392 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.39 | 10.17 | -2.53 | 1 | 1 | 0 | 12 | 263.384 | 4 | ↓ |