In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 18 | Yes |
Popular Name: 2-methyl-N-[[1-[(1R,3R)-3-methylcyclohexyl]tetrazol-5-yl]methyl]propan-1-amine 2-methyl-N-[[1-[(1R,3R)-3-methyl…
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) | 2.02 | 6.81 | -54.48 | 2 | 5 | 1 | 60 | 252.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 5.6 | -10.09 | 1 | 5 | 0 | 56 | 251.378 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.