In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 22 | 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) | 2.40 | 1.43 | -10.14 | 0 | 6 | 0 | 61 | 322.727 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 1.71 | -38.13 | 1 | 6 | 1 | 63 | 323.735 | 2 | ↓ |