In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 17 | Yes |
Popular Name: N-[(3-phenyl-1H-pyrazol-4-yl)methyl]propane-1,3-diamine N-[(3-phenyl-1H-pyrazol-4-yl)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) | 0.55 | 3.23 | -111.08 | 6 | 4 | 2 | 73 | 232.331 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 1.87 | -44.69 | 5 | 4 | 1 | 68 | 231.323 | 6 | ↓ |