In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2011 | 18 | Yes |
Popular Name: 4-chloro-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]benzoic 4-chloro-2-[(3-methyl-1,2,4-oxad…
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) | 1.97 | 3.88 | -47.38 | 1 | 6 | -1 | 91 | 266.664 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | 1.89 | -9.98 | 2 | 6 | 0 | 88 | 267.672 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.