In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 20 | Yes |
Popular Name: 4-cyano-N-[(3S)-1-ethyl-3-piperidyl]benzenesulfonamide 4-cyano-N-[(3S)-1-ethyl-3-piperi…
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) | 1.56 | 4.9 | -48.35 | 2 | 5 | 1 | 74 | 294.4 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 4.75 | -37.5 | 1 | 5 | 0 | 76 | 293.392 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 2.68 | -9.61 | 1 | 5 | 0 | 73 | 293.392 | 4 | ↓ |