In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | Yes |
Popular Name: N-[(2S,4aS,8aR)-decalin-2-yl]-1-(2-methoxyethyl)pyrazol-4-amine N-[(2S,4aS,8aR)-decalin-2-yl]-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) | 3.64 | 6.4 | -4.4 | 1 | 4 | 0 | 39 | 277.412 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.64 | 6.49 | -41.8 | 2 | 4 | 1 | 44 | 278.42 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.