In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 28 | 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) | 4.92 | 8.7 | -10.74 | 1 | 4 | 0 | 42 | 431.379 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.92 | 10.95 | -47.29 | 2 | 4 | 1 | 43 | 432.387 | 5 | ↓ |