In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2005 | 19 | 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) | 1.99 | 8.78 | -11.04 | 0 | 6 | 0 | 62 | 262.313 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 9.26 | -46.62 | 1 | 6 | 1 | 63 | 263.321 | 5 | ↓ |