In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 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) | 3.62 | 9.05 | -11.91 | 1 | 6 | 0 | 76 | 437.467 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.03 | 9.7 | -18.21 | 0 | 6 | 0 | 73 | 437.467 | 8 | ↓ |