In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | No |
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) | 4.10 | 6.29 | -10.92 | 2 | 5 | 0 | 78 | 313.14 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 7.04 | -40.27 | 1 | 5 | -1 | 81 | 312.132 | 4 | ↓ |