In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 17 | Yes |
Popular Name: 1-[1-[(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]tetrazol-5-yl]-N-methyl-methanamine 1-[1-[(1S)-1-(2,5-dimethyl-3-thi…
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) | 0.97 | 5.38 | -56.66 | 2 | 5 | 1 | 60 | 252.367 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 3.94 | -11.51 | 1 | 5 | 0 | 56 | 251.359 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.