In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 30 | Yes |
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) | 1.55 | 6.11 | -19.34 | 2 | 8 | 0 | 97 | 410.474 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 5.7 | -54.76 | 2 | 8 | 0 | 101 | 410.474 | 7 | ↓ |