In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 20 | 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) | 1.00 | 4.46 | -77.41 | 3 | 4 | 2 | 28 | 282.476 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.00 | 6.73 | -169.73 | 4 | 4 | 3 | 29 | 283.484 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.00 | 5.4 | -79.21 | 3 | 4 | 2 | 24 | 282.476 | 4 | ↓ |