In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2007 | 31 | 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) | 4.10 | -0.12 | -15.1 | 0 | 6 | 0 | 64 | 431.517 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.10 | -0.01 | -44.47 | 1 | 6 | 1 | 65 | 432.525 | 4 | ↓ |