In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 21 | Yes |
Popular Name: (1S,2S,3S,4R)-3-[[1-[(1R)-1-methylpropyl]pyrazol-3-yl]methylamino]norbornane-2-carboxylic (1S,2S,3S,4R)-3-[[1-[(1R)-1-meth…
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) | 2.31 | 8.21 | -47.14 | 2 | 5 | 0 | 75 | 291.395 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 7.12 | -57.73 | 1 | 5 | -1 | 70 | 290.387 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.