In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 18 | 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) | 1.00 | -2.78 | -11.7 | 2 | 7 | 0 | 88 | 251.29 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.00 | -2.6 | -30.53 | 3 | 7 | 1 | 89 | 252.298 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.00 | -2.63 | -35.34 | 3 | 7 | 1 | 89 | 252.298 | 6 | ↓ |