In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2009 | 13 | Yes |
Popular Name: Phenol, 2-[(2S)-3-amino-2-hydroxypropoxy]- (9CI) Phenol, 2-[(2S)-3-amino-2-hydrox…
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CAS Number: 437765-36-1
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) | -0.54 | -2.25 | -49.44 | 5 | 4 | 1 | 77 | 184.215 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.54 | -2.62 | -8.44 | 4 | 4 | 0 | 76 | 183.207 | 4 | ↓ |