In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2010 | 31 | 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) | 0.60 | 7.63 | -16.12 | 0 | 8 | 0 | 75 | 420.517 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.60 | 9.78 | -54.81 | 1 | 8 | 1 | 76 | 421.525 | 4 | ↓ |