In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2010 | 29 | 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) | 3.34 | 6.88 | -30.39 | 2 | 6 | 1 | 63 | 389.479 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 4.73 | -10.64 | 1 | 6 | 0 | 62 | 388.471 | 5 | ↓ |