In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 25 | Yes |
Popular Name: 2-[4-[(2S)-2-hydroxy-3-(2-methylphenoxy)propyl]piperazin-1-yl]-N-isopropyl-acetamide 2-[4-[(2S)-2-hydroxy-3-(2-methyl…
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) | 1.95 | 1.84 | -11.27 | 2 | 6 | 0 | 65 | 349.475 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 4.15 | -42.68 | 3 | 6 | 1 | 66 | 350.483 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.