In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 26 | 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) | -0.07 | 0.72 | -20.48 | 2 | 10 | 0 | 114 | 383.478 | 9 | ↓ |
Mid Mid (pH 6-8) | -0.07 | 2.98 | -57.61 | 3 | 10 | 1 | 115 | 384.486 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.