In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 20 | Yes |
Popular Name: 2-chloro-4-[[(3S,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzonitrile 2-chloro-4-[[(3S,5R)-3,5-dimethy…
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) | 3.24 | 6.46 | -8.85 | 0 | 4 | 0 | 61 | 312.822 | 2 | ↓ |