In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 30 | 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) | 1.09 | 6.96 | -17.05 | 0 | 7 | 0 | 60 | 431.537 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 9.21 | -70.36 | 1 | 7 | 1 | 61 | 432.545 | 4 | ↓ |