In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 16 | 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) | 2.24 | 9.36 | -36.62 | 2 | 2 | 1 | 30 | 211.288 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 8.56 | -8.12 | 1 | 2 | 0 | 29 | 210.28 | 1 | ↓ |