In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 35 | 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) | 4.59 | 10.23 | -12.78 | 1 | 6 | 0 | 64 | 495.689 | 12 | ↓ |
Mid Mid (pH 6-8) | 4.59 | 12.51 | -56.97 | 2 | 6 | 1 | 65 | 496.697 | 12 | ↓ |