In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2005 | 29 | 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) | 5.79 | 12.95 | -11.25 | 1 | 4 | 0 | 47 | 384.479 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.79 | 13.42 | -30.84 | 2 | 4 | 1 | 48 | 385.487 | 7 | ↓ |