In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 36 | 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) | -0.26 | 5.41 | -14.01 | 0 | 10 | 0 | 91 | 488.596 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.26 | 7.63 | -55.6 | 1 | 10 | 1 | 92 | 489.604 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.26 | 7.63 | -56.88 | 1 | 10 | 1 | 92 | 489.604 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.26 | 9.85 | -109.68 | 2 | 10 | 2 | 93 | 490.612 | 6 | ↓ |