In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 29 | No |
None
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) | 5.13 | 13.57 | -7.31 | 0 | 3 | 0 | 39 | 391.555 | 3 | ↓ |
Mid Mid (pH 6-8) | 5.13 | 14.16 | -37.52 | 1 | 3 | 1 | 40 | 392.563 | 3 | ↓ |