In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 30 | 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) | 0.95 | 5.74 | -142.29 | 2 | 8 | -2 | 147 | 440.429 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.95 | 4.58 | -50 | 3 | 8 | -1 | 144 | 441.437 | 4 | ↓ |