In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 21 | Yes |
Popular Name: 1-[(1S)-1-(1-tert-butyltetrazol-5-yl)-3-methyl-butyl]-4-methyl-piperazine 1-[(1S)-1-(1-tert-butyltetrazol-…
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) | 2.14 | 5.95 | -38.78 | 1 | 6 | 1 | 51 | 295.455 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 5.42 | -41.46 | 1 | 6 | 1 | 51 | 295.455 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 3.48 | -9.76 | 0 | 6 | 0 | 50 | 294.447 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.