In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 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) | 3.18 | 6.02 | -39.72 | 2 | 2 | 1 | 26 | 271.178 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 4.72 | -2.51 | 1 | 2 | 0 | 21 | 270.17 | 2 | ↓ |