In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: (1R)-1-(1-methylpyrazol-4-yl)-1-phenyl-butan-1-amine (1R)-1-(1-methylpyrazol-4-yl)-1-…
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) | 2.79 | 5.9 | -48.62 | 3 | 3 | 1 | 45 | 230.335 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 5.68 | -6.12 | 2 | 3 | 0 | 44 | 229.327 | 4 | ↓ |