In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 20 | Yes |
Popular Name: 2-[(3S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-3-piperidyl]acetic 2-[(3S)-1-[(3,5-dimethyl-1H-pyra…
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) | 0.29 | 2.45 | -54.65 | 1 | 7 | -1 | 106 | 300.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.29 | 1.32 | -16.77 | 2 | 7 | 0 | 103 | 301.368 | 4 | ↓ |