In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: (S)-(1-ethylpyrazol-4-yl)-(3-methoxyphenyl)methanamine (S)-(1-ethylpyrazol-4-yl)-(3-met…
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) | 1.69 | 4.19 | -49.19 | 3 | 4 | 1 | 55 | 232.307 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.69 | 3.85 | -7.84 | 2 | 4 | 0 | 53 | 231.299 | 4 | ↓ |