In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 14 | 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) | 0.30 | 4.13 | -38.25 | 1 | 3 | 1 | 25 | 195.286 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 6.2 | -111.41 | 2 | 3 | 2 | 26 | 196.294 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.