In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 31 | Yes |
None
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) | 2.98 | 13.19 | -47.36 | 1 | 7 | 1 | 64 | 416.505 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 10.98 | -14.78 | 0 | 7 | 0 | 63 | 415.497 | 4 | ↓ |