In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 27 | 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) | 2.40 | 8.63 | -53.57 | 4 | 7 | 1 | 88 | 392.549 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 6.52 | -14.85 | 3 | 7 | 0 | 87 | 391.541 | 4 | ↓ |