In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 28 | 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) | 2.69 | 5.86 | -15.71 | 3 | 7 | 0 | 89 | 384.48 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 7.08 | -48.6 | 4 | 7 | 1 | 93 | 385.488 | 5 | ↓ |