In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2012 | 17 | Yes |
Popular Name: 3-[(3S,4R)-4-aminotetrahydropyran-3-yl]sulfanyl-4-cyclopropyl-1H-1,2,4-triazol-5-one 3-[(3S,4R)-4-aminotetrahydropyra…
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) | -0.65 | 1.74 | -57.11 | 4 | 6 | 1 | 88 | 257.339 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.