In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2006 | 30 | 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) | 4.08 | 10.3 | -15.21 | 1 | 5 | 0 | 62 | 397.478 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.08 | 11.15 | -35.48 | 2 | 5 | 1 | 63 | 398.486 | 4 | ↓ |