In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 19 | Yes |
Popular Name: 4-bromo-2-[(1S)-1-(2-diethylaminoethylamino)propyl]phenol 4-bromo-2-[(1S)-1-(2-diethylamin…
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) | 3.16 | 4.95 | -39.16 | 3 | 3 | 1 | 40 | 330.29 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.16 | 5.73 | -41.44 | 2 | 3 | 0 | 43 | 329.282 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 5.94 | -35.86 | 3 | 3 | 1 | 37 | 330.29 | 8 | ↓ |