In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | 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) | 3.03 | 6.57 | -8.9 | 1 | 3 | 0 | 42 | 307.191 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.03 | 7.04 | -40.83 | 2 | 3 | 1 | 43 | 308.199 | 3 | ↓ |