In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 17 | 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) | 1.04 | 2.95 | -11.93 | 0 | 5 | 0 | 42 | 242.319 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.04 | 5.19 | -48.12 | 1 | 5 | 1 | 43 | 243.327 | 4 | ↓ |