In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 35 | No |
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 | 7.93 | -30.95 | 1 | 10 | 0 | 120 | 472.457 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 8.37 | -78.16 | 2 | 10 | 1 | 121 | 473.465 | 7 | ↓ |