In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 21 | Yes |
Popular Name: N-[3-[(1S)-1-hydroxyethyl]phenyl]-4-isopropyl-piperazine-1-carboxamide N-[3-[(1S)-1-hydroxyethyl]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) | 1.80 | 5.5 | -44.75 | 3 | 5 | 1 | 57 | 292.403 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 3.34 | -10.08 | 2 | 5 | 0 | 56 | 291.395 | 3 | ↓ |