In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: 4-[(1R)-1-[[(1R)-4-diethylamino-1-methyl-butyl]amino]ethyl]phenol 4-[(1R)-1-[[(1R)-4-diethylamino-…
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) | 3.23 | 8.11 | -103.9 | 4 | 3 | 2 | 41 | 280.456 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 8.89 | -115.23 | 3 | 3 | 1 | 44 | 279.448 | 9 | ↓ |