In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2009 | 24 | 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) | 0.90 | 4.33 | -71.96 | 1 | 7 | -1 | 90 | 331.327 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 3.57 | -19.26 | 2 | 7 | 0 | 87 | 332.335 | 3 | ↓ |