In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 19 | Yes |
Popular Name: 5-[[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]-3H-1,3-benzoxazol-2-one 5-[[(1S)-1-(3-methyl-1,2,4-oxadi…
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) | 1.05 | 0.71 | -12.9 | 2 | 7 | 0 | 97 | 260.253 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.51 | -1.93 | -51.86 | 1 | 7 | -1 | 100 | 259.245 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.