In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 25 | Yes |
Popular Name: 5-(4-tetralin-6-ylsulfonylpiperazin-1-yl)pentanenitrile 5-(4-tetralin-6-ylsulfonylpipera…
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) | 2.56 | 7.28 | -14.2 | 0 | 5 | 0 | 64 | 361.511 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 9.48 | -57.97 | 1 | 5 | 1 | 66 | 362.519 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.