In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: N-[(2S,4aR,8aR)-decalin-2-yl]-2-methyl-1H-benzimidazol-5-amine N-[(2S,4aR,8aR)-decalin-2-yl]-2-…
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) | 4.83 | 8.79 | -7.32 | 2 | 3 | 0 | 41 | 283.419 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.83 | 9.23 | -26.9 | 3 | 3 | 1 | 42 | 284.427 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.