In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 28 | 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) | 3.16 | 9.72 | -35.29 | 2 | 5 | 1 | 46 | 384.544 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 7.26 | -8.05 | 1 | 5 | 0 | 45 | 383.536 | 4 | ↓ |