In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 16 | Yes |
Popular Name: 1-[5-[(3-chlorophenyl)methyl]-1,2,4-oxadiazol-3-yl]-N-methyl-methanamine 1-[5-[(3-chlorophenyl)methyl]-1,…
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) | 2.21 | 4.04 | -42.04 | 2 | 4 | 1 | 56 | 238.698 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 2.6 | -7.6 | 1 | 4 | 0 | 51 | 237.69 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.