In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2009 | 15 | No |
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) | 3.29 | 6.1 | -33.26 | 2 | 2 | 1 | 26 | 242.129 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 5.71 | -8.6 | 1 | 2 | 0 | 25 | 241.121 | 3 | ↓ |