In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 23 | 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) | 3.17 | 10.42 | -45.56 | 2 | 3 | 1 | 44 | 308.449 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 8.56 | -8.14 | 1 | 3 | 0 | 43 | 307.441 | 3 | ↓ |