In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 16 | No |
Popular Name: 2-[5-(cyclopentylsulfanylmethyl)-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-(cyclopentylsulfanylmethyl)…
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) | 2.12 | 3.07 | -41.68 | 3 | 4 | 1 | 67 | 242.368 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 2.8 | -5.55 | 2 | 4 | 0 | 65 | 241.36 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.