In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 38 | 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) | 3.23 | 7.49 | -59.21 | 0 | 9 | -1 | 101 | 521.59 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 9.76 | -68.72 | 1 | 9 | 0 | 102 | 522.598 | 10 | ↓ |