In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 26 | 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) | 4.12 | 12.17 | -41.72 | 2 | 3 | 1 | 34 | 387.594 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.12 | 10.01 | -7.53 | 1 | 3 | 0 | 32 | 386.586 | 5 | ↓ |