In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 18 | Yes |
Popular Name: 2-methoxy-N-[[(2R)-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]methyl]ethanamine 2-methoxy-N-[[(2R)-1-[(1-methylp…
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) | -0.07 | 3.56 | -41.95 | 2 | 5 | 1 | 47 | 253.37 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.07 | 1.79 | -6.69 | 1 | 5 | 0 | 42 | 252.362 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.07 | 5.34 | -116.44 | 3 | 5 | 2 | 48 | 254.378 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.