In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 19 | 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) | 3.21 | 9.26 | -56.23 | 0 | 4 | -1 | 58 | 257.313 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.21 | 9.68 | -50.04 | 1 | 4 | 0 | 59 | 258.321 | 4 | ↓ |