In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | 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) | 2.02 | 5.89 | -9.18 | 2 | 3 | 0 | 52 | 267.357 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.02 | 6.34 | -36.66 | 3 | 3 | 1 | 53 | 268.365 | 3 | ↓ |