In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (3R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-3-pyrrolidin-1-yl-piperidine (3R)-1-[(3,5-dimethyl-1H-pyrazol…
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) | 0.83 | 4.52 | -42.1 | 2 | 6 | 1 | 70 | 313.447 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.83 | 2.11 | -9.61 | 1 | 6 | 0 | 69 | 312.439 | 3 | ↓ |