In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2011 | 24 | Yes |
Popular Name: 1-[2-[(2S)-4-(2,1,3-benzoxadiazol-5-ylmethyl)morpholin-2-yl]ethyl]-3-ethyl-urea 1-[2-[(2S)-4-(2,1,3-benzoxadiazo…
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) | 1.23 | 1.2 | -19.14 | 2 | 8 | 0 | 93 | 333.392 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.23 | 3.48 | -69.95 | 3 | 8 | 1 | 94 | 334.4 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.