In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 28 | 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) | 2.14 | 6.03 | -12.15 | 1 | 6 | 0 | 60 | 384.476 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 8.01 | -51.33 | 2 | 6 | 1 | 61 | 385.484 | 7 | ↓ |