In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: 4-bromo-2-[(1S)-1-[(1-cyclopropyl-4-piperidyl)amino]propyl]phenol 4-bromo-2-[(1S)-1-[(1-cyclopropy…
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) | 3.17 | 7.27 | -31.22 | 3 | 3 | 1 | 37 | 354.312 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.17 | 6.54 | -36.59 | 2 | 3 | 0 | 43 | 353.304 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 5.83 | -37.27 | 3 | 3 | 1 | 40 | 354.312 | 5 | ↓ |