In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 23 | 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) | 3.31 | 8.21 | -18.03 | 1 | 6 | 0 | 88 | 307.309 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.38 | 6.33 | -36.16 | 2 | 6 | 1 | 93 | 308.317 | 3 | ↓ |