In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 17 | Yes |
Popular Name: N-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,2,2-trifluoro-ethanamine N-[2-(4-cyclopropylpiperazin-1-y…
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) | 0.96 | 3.48 | -32.55 | 2 | 3 | 1 | 20 | 252.304 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.96 | 1.26 | -3.03 | 1 | 3 | 0 | 19 | 251.296 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 4.84 | -93.83 | 3 | 3 | 2 | 24 | 253.312 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.