In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2006 | 30 | 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) | 1.95 | 6.12 | -63.23 | 2 | 8 | -1 | 127 | 410.402 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 6.95 | -60.84 | 1 | 8 | -1 | 124 | 410.402 | 8 | ↓ |