In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 20 | Yes |
Popular Name: 4-[[[(1S)-1-(4-chlorophenyl)-2-methyl-propyl]amino]methyl]phenol 4-[[[(1S)-1-(4-chlorophenyl)-2-m…
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) | 4.40 | 7.59 | -47.86 | 3 | 2 | 1 | 37 | 290.814 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.40 | 6.6 | -4.02 | 2 | 2 | 0 | 32 | 289.806 | 5 | ↓ |