In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | Yes |
Popular Name: 4-[(1R)-1-[[(1S)-3-methyl-1-phenyl-butyl]amino]ethyl]phenol 4-[(1R)-1-[[(1S)-3-methyl-1-phen…
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) | 3.91 | 8.69 | -38.8 | 3 | 2 | 1 | 37 | 284.423 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 7.91 | -4.48 | 2 | 2 | 0 | 32 | 283.415 | 6 | ↓ |