In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | Yes |
Popular Name: (1S)-1-(2-furyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]ethanamine (1S)-1-(2-furyl)-N-[(4-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) | 1.63 | 2.23 | -12.6 | 1 | 5 | 0 | 64 | 207.233 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.63 | 3.43 | -51.82 | 2 | 5 | 1 | 69 | 208.241 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.