In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 35 | 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) | 4.49 | 9.26 | -18 | 2 | 9 | 0 | 108 | 492.557 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 9.06 | -50.06 | 1 | 9 | -1 | 106 | 491.549 | 11 | ↓ |