In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2010 | 14 | 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) | 1.44 | 6.52 | -113.42 | 3 | 2 | 2 | 21 | 192.306 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 4.2 | -39.03 | 2 | 2 | 1 | 20 | 191.298 | 3 | ↓ |