In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 12 | 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) | 1.12 | 2.65 | -34.53 | 3 | 3 | 1 | 46 | 173.28 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.12 | 1.68 | -8.81 | 2 | 3 | 0 | 41 | 172.272 | 5 | ↓ |