In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 20 | Yes |
Popular Name: N-[[5-(4-tert-butylcyclohexyl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine N-[[5-(4-tert-butylcyclohexyl)-1…
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) | 2.42 | 4.21 | -42.72 | 2 | 4 | 1 | 56 | 280.436 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.42 | 2.86 | -5.97 | 1 | 4 | 0 | 51 | 279.428 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.