In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 19 | 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) | 3.91 | 7.41 | -9.07 | 0 | 3 | 0 | 31 | 255.317 | 5 | ↓ |
Ref Reference (pH 7) | 3.91 | 6.63 | -7.74 | 0 | 3 | 0 | 31 | 255.317 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.91 | 7.06 | -31.64 | 1 | 3 | 1 | 32 | 256.325 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.91 | 7.76 | -30.52 | 1 | 3 | 1 | 32 | 256.325 | 5 | ↓ |