In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 19 | Yes |
Popular Name: 1-[(1S)-2-(4-methoxyphenyl)-1-methyl-ethyl]-4-methyl-1,4-diazepane 1-[(1S)-2-(4-methoxyphenyl)-1-me…
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) | 2.70 | 7.95 | -36.79 | 1 | 3 | 1 | 17 | 263.405 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 7.54 | -32.67 | 1 | 3 | 1 | 17 | 263.405 | 4 | ↓ |