In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 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) | 1.29 | 4.03 | -48.13 | 0 | 4 | -1 | 53 | 240.304 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 6.14 | -27.17 | 1 | 4 | 0 | 54 | 241.312 | 3 | ↓ |