In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2009 | 30 | 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) | 0.01 | 6.37 | -99.65 | 3 | 7 | 0 | 102 | 429.37 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 6.18 | -66.76 | 2 | 7 | -1 | 101 | 428.362 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.74 | 5.41 | -73.14 | 4 | 7 | 1 | 105 | 430.378 | 4 | ↓ |