In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2009 | 24 | Yes |
None
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) | 2.13 | 1.53 | -51.26 | 1 | 7 | -1 | 99 | 320.332 | 2 | ↓ |
Ref Reference (pH 7) | 1.95 | 4.28 | -46.38 | 1 | 7 | -1 | 96 | 320.332 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.67 | 3.42 | -11.02 | 2 | 7 | 0 | 96 | 321.34 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.49 | 6.1 | -10.52 | 2 | 7 | 0 | 93 | 321.34 | 2 | ↓ |