In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 16 | Yes |
Popular Name: (2S)-2-(4-chlorophenyl)-2-(prop-2-ynylamino)propanoic (2S)-2-(4-chlorophenyl)-2-(prop-…
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) | 2.21 | 7.32 | -30.29 | 2 | 3 | 0 | 57 | 237.686 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 6.16 | -41.06 | 1 | 3 | -1 | 52 | 236.678 | 4 | ↓ |