In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 32 | 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) | 3.34 | 8.29 | -51.89 | 2 | 7 | 1 | 88 | 476.644 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 5.98 | -22.45 | 1 | 7 | 0 | 87 | 475.636 | 6 | ↓ |