In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2006 | 28 | 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) | 2.32 | 3.1 | -14.08 | 3 | 8 | 0 | 115 | 384.436 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.32 | 3.43 | -58.52 | 4 | 8 | 1 | 117 | 385.444 | 8 | ↓ |