In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 29 | 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) | 3.57 | 12.66 | -47.66 | 1 | 4 | 1 | 38 | 387.503 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 10.42 | -12.87 | 0 | 4 | 0 | 37 | 386.495 | 4 | ↓ |