| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 21 | Yes |
Popular Name: (1S)-1-[3,5-dimethyl-1-(3-phenylpropyl)pyrazol-4-yl]-N-methyl-propan-1-amine (1S)-1-[3,5-dimethyl-1-(3-phenyl…
| 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) | 2.80 | 9.99 | -39.45 | 2 | 3 | 1 | 34 | 286.443 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 8.83 | -6.59 | 1 | 3 | 0 | 30 | 285.435 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 10.09 | -95.75 | 3 | 3 | 2 | 36 | 287.451 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
