| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: 1,3,5-trimethyl-N-[(1R)-1-(3-methylbenzothiophen-2-yl)ethyl]pyrazol-4-amine 1,3,5-trimethyl-N-[(1R)-1-(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) | 4.16 | 8.44 | -8.36 | 1 | 3 | 0 | 30 | 299.443 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 8.57 | -29.95 | 2 | 3 | 1 | 31 | 300.451 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
