In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 21 | No |
Popular Name: 1-tert-butyl-4-[(2R)-2-isocyanato-2-phenyl-ethyl]benzene 1-tert-butyl-4-[(2R)-2-isocyanat…
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) | 5.16 | 9.53 | -4 | 0 | 2 | 0 | 29 | 279.383 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.16 | 10.6 | -40.51 | 1 | 2 | 1 | 31 | 280.391 | 5 | ↓ |