In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | Yes |
Popular Name: 1-[2-[[(2S)-tetrahydropyran-2-yl]methoxy]phenyl]-1,4-diazepane 1-[2-[[(2S)-tetrahydropyran-2-yl…
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) | 2.50 | 7.65 | -40.31 | 2 | 4 | 1 | 38 | 291.415 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 6.36 | -4.94 | 1 | 4 | 0 | 34 | 290.407 | 4 | ↓ |