In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: 2,4-dichloro-6-[[[(1S)-2-(3-chlorophenyl)-1-methyl-ethyl]amino]methyl]phenol 2,4-dichloro-6-[[[(1S)-2-(3-chlo…
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) | 5.28 | 7.16 | -3.83 | 2 | 2 | 0 | 32 | 344.669 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.28 | 7.91 | -35.15 | 1 | 2 | -1 | 35 | 343.661 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.28 | 8.38 | -43.4 | 3 | 2 | 1 | 37 | 345.677 | 5 | ↓ |