In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 19 | Yes |
Popular Name: 2-[1-[(1-butyltetrazol-5-yl)methyl]triazol-4-yl]propan-2-amine 2-[1-[(1-butyltetrazol-5-yl)meth…
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) | 0.80 | 2.45 | -58.99 | 3 | 8 | 1 | 102 | 265.345 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 2.19 | -14.46 | 2 | 8 | 0 | 100 | 264.337 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.