In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2005 | 27 | 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) | 3.78 | 9.57 | -13.64 | 1 | 4 | 0 | 49 | 372.553 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.57 | -0.7 | -43.55 | 1 | 4 | 1 | 51 | 373.561 | 3 | ↓ |