In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 21 | 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) | 1.70 | 6.04 | -70.31 | 1 | 6 | 0 | 82 | 312.391 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 3.87 | -52.3 | 0 | 6 | -1 | 81 | 311.383 | 4 | ↓ |