In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 20 | 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) | 2.65 | 9.16 | -74.81 | 3 | 3 | 2 | 21 | 281.488 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 7.79 | -96.46 | 3 | 3 | 2 | 24 | 281.488 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 10.05 | -184.5 | 4 | 3 | 3 | 25 | 282.496 | 4 | ↓ |