In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | Yes |
Popular Name: 4-[[[(1S)-1-(3-chlorophenyl)ethyl]amino]methyl]phenol 4-[[[(1S)-1-(3-chlorophenyl)ethy…
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) | 3.63 | 6.66 | -46.74 | 3 | 2 | 1 | 37 | 262.76 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 5.39 | -6.64 | 2 | 2 | 0 | 32 | 261.752 | 4 | ↓ |