In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 19 | Yes |
Popular Name: (3S)-3-amino-3-[3-[(2,6-dichlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]propan-1-ol (3S)-3-amino-3-[3-[(2,6-dichloro…
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) | 0.38 | 0.56 | -50.69 | 4 | 5 | 1 | 87 | 303.169 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.38 | 0.26 | -8.02 | 3 | 5 | 0 | 85 | 302.161 | 5 | ↓ |