In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 14 | 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) | 1.03 | 3.05 | -42.28 | 2 | 3 | 1 | 33 | 195.286 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.03 | 5.29 | -117.73 | 3 | 3 | 2 | 34 | 196.294 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.03 | 3.9 | -34.26 | 2 | 3 | 1 | 30 | 195.286 | 3 | ↓ |