In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 37 | 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) | 3.76 | 5.86 | -15.46 | 4 | 9 | 0 | 115 | 524.984 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 8.14 | -47.41 | 5 | 9 | 1 | 116 | 525.992 | 7 | ↓ |