In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 19 | Yes |
Popular Name: 4-[(1S)-1-[(3-dimethylamino-2,2-dimethyl-propyl)amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[(3-dimethylamino-2,2-…
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) | 2.68 | 2.83 | -36.73 | 4 | 4 | 1 | 57 | 267.393 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 4.64 | -92.61 | 4 | 4 | 1 | 64 | 267.393 | 6 | ↓ |