In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 37 | No |
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) | 2.62 | 8.95 | -53 | 0 | 8 | -1 | 95 | 498.559 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 11.28 | -68.86 | 1 | 8 | 0 | 96 | 499.567 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.62 | 9.99 | -60.37 | 2 | 8 | 1 | 93 | 500.575 | 9 | ↓ |