In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2008 | 28 | 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) | 1.47 | 7.3 | -18.59 | 1 | 7 | 0 | 76 | 384.48 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 7.43 | -42.93 | 2 | 7 | 1 | 78 | 385.488 | 7 | ↓ |