In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 29 | Yes |
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) | 0.85 | 4.04 | -18.62 | 1 | 7 | 0 | 71 | 410.486 | 12 | ↓ |
Mid Mid (pH 6-8) | 0.85 | 6.35 | -53.51 | 2 | 7 | 1 | 73 | 411.494 | 12 | ↓ |