In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 30 | No |
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) | 4.66 | 10.44 | -34.27 | 2 | 5 | 1 | 55 | 421.487 | 3 | ↓ |
Ref Reference (pH 7) | 4.48 | 10.62 | -10.42 | 1 | 5 | 0 | 50 | 420.479 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.66 | 9.49 | -6.8 | 1 | 5 | 0 | 53 | 420.479 | 3 | ↓ |