In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 37 | 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) | 6.00 | 14.88 | -10.86 | 0 | 4 | 0 | 36 | 530.137 | 10 | ↓ |
Lo Low (pH 4.5-6) | 6.00 | 16.97 | -52.76 | 1 | 4 | 1 | 38 | 531.145 | 10 | ↓ |