In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 14 | Yes |
Popular Name: (1S)-1-(1-ethylpyrazol-4-yl)-4-methyl-pentan-1-amine (1S)-1-(1-ethylpyrazol-4-yl)-4-m…
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) | 0.10 | 4.73 | -45.6 | 3 | 3 | 1 | 45 | 196.318 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 4.39 | -5.43 | 2 | 3 | 0 | 44 | 195.31 | 5 | ↓ |