In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 36 | 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) | 7.64 | 15.43 | -10.61 | 0 | 6 | 0 | 62 | 502.636 | 8 | ↓ |
Ref Reference (pH 7) | 7.64 | 14.06 | -10.57 | 0 | 6 | 0 | 62 | 502.636 | 8 | ↓ |
Lo Low (pH 4.5-6) | 7.64 | 14.59 | -31.28 | 1 | 6 | 1 | 64 | 503.644 | 8 | ↓ |
Lo Low (pH 4.5-6) | 7.64 | 15.78 | -29.44 | 1 | 6 | 1 | 64 | 503.644 | 8 | ↓ |