In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 21 | Yes |
Popular Name: (1S)-1-(4-tert-butylphenyl)-2-[[(2S)-tetrahydropyran-2-yl]methoxy]ethanamine (1S)-1-(4-tert-butylphenyl)-2-[[…
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) | 2.00 | 6.95 | -43.15 | 3 | 3 | 1 | 46 | 292.443 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 6.62 | -4.45 | 2 | 3 | 0 | 44 | 291.435 | 6 | ↓ |