In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 27 | Yes |
Popular Name: (3S)-1-[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-3-carboxylic (3S)-1-[2-[[4-allyl-5-(4-pyridyl…
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) | 1.22 | 8.84 | -57.62 | 0 | 8 | -1 | 104 | 386.457 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.