| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 16 | No |
Popular Name: [4-(2-chloroethyl)piperazin-1-yl]-[(2S)-tetrahydrothiophen-2-yl]methanone [4-(2-chloroethyl)piperazin-1-yl…
| 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) | 1.08 | 4.97 | -8.44 | 0 | 3 | 0 | 24 | 262.806 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.08 | 7.19 | -46.48 | 1 | 3 | 1 | 25 | 263.814 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
