In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 18 | Yes |
Popular Name: 4-isopropyl-5-[3-[(2R)-pyrrolidin-2-yl]propylsulfanyl]-1,2,4-triazol-3-amine 4-isopropyl-5-[3-[(2R)-pyrrolidi…
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) | 1.64 | 8.28 | -46.22 | 4 | 5 | 1 | 73 | 270.426 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.