In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 9 | 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) | 0.15 | 2.02 | -102.19 | 5 | 2 | 2 | 44 | 130.235 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.15 | 1.64 | -33.27 | 4 | 2 | 1 | 43 | 129.227 | 4 | ↓ |