In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 22 | No |
Popular Name: 2-[5-[(2-fluoro-6-nitro-phenyl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethyl-ethanamine 2-[5-[(2-fluoro-6-nitro-phenyl)m…
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) | 1.89 | 8.29 | -49.45 | 1 | 8 | 1 | 94 | 327.365 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 5.83 | -12.65 | 0 | 8 | 0 | 93 | 326.357 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.