| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 18 | Yes |
Popular Name: (1R)-N-[(1-methylpyrazol-4-yl)methyl]-1-(4-methylsulfanylphenyl)ethanamine (1R)-N-[(1-methylpyrazol-4-yl)me…
| 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) | 2.27 | 7.69 | -46.16 | 2 | 3 | 1 | 34 | 262.402 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.27 | 6.58 | -7.43 | 1 | 3 | 0 | 30 | 261.394 | 5 | ↓ |
