In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 34 | 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) | 6.38 | 10.34 | -49.37 | 0 | 6 | -1 | 84 | 491.614 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.92 | 11.58 | -19.75 | 1 | 6 | 0 | 81 | 492.622 | 7 | ↓ |