In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2007 | 32 | 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) | 3.79 | 1.99 | -9.86 | 0 | 8 | 0 | 77 | 432.459 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 2.3 | -36.59 | 1 | 8 | 1 | 78 | 433.467 | 4 | ↓ |