In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 37 | 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) | 3.33 | 14.3 | -15.84 | 0 | 7 | 0 | 71 | 495.627 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 15.63 | -36.03 | 1 | 7 | 1 | 73 | 496.635 | 8 | ↓ |