In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2011 | 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) | 1.16 | 0.95 | -5.28 | 4 | 3 | 0 | 58 | 194.278 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 1.37 | -36.38 | 5 | 3 | 1 | 63 | 195.286 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 0.81 | -41.64 | 5 | 3 | 1 | 60 | 195.286 | 5 | ↓ |