In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 36 | 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) | 5.89 | 12.93 | -57.63 | 2 | 5 | 1 | 54 | 491.627 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.89 | 10.54 | -10.1 | 1 | 5 | 0 | 53 | 490.619 | 9 | ↓ |