In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 27 | 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) | -0.59 | 4.8 | -108.47 | 3 | 7 | 0 | 94 | 374.416 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 6.74 | -145.11 | 5 | 7 | 2 | 96 | 376.432 | 5 | ↓ |
Mid Mid (pH 6-8) | -3.34 | 3.84 | -78.57 | 4 | 7 | 1 | 97 | 375.424 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 6.15 | -192.76 | 4 | 7 | 1 | 99 | 375.424 | 5 | ↓ |