In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 12 | 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) | 0.40 | 2.65 | -87.31 | 3 | 3 | 2 | 24 | 173.304 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.40 | 0.26 | -39.08 | 2 | 3 | 1 | 23 | 172.296 | 4 | ↓ |