In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 27 | 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) | 3.73 | 8.43 | -12.84 | 2 | 6 | 0 | 84 | 383.473 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 7.32 | -41.66 | 1 | 6 | -1 | 87 | 382.465 | 7 | ↓ |