In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 35 | Yes |
Popular Name: dibenzyl-[(2S)-3-(N-besylanilino)-2-hydroxy-propyl]ammonium dibenzyl-[(2S)-3-(N-besylanilino…
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) | 5.13 | 13.1 | -49.89 | 2 | 5 | 1 | 62 | 487.645 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.13 | 11.08 | -11.83 | 1 | 5 | 0 | 61 | 486.637 | 11 | ↓ |