In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | 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) | 1.69 | 5.93 | -126.18 | 4 | 4 | 2 | 51 | 280.412 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.69 | 6.03 | -32.12 | 3 | 4 | 1 | 49 | 279.404 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 4.45 | -49 | 3 | 4 | 1 | 49 | 279.404 | 5 | ↓ |