In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 25 | Yes |
Popular Name: (6R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-4-(1H-pyrazol-3-ylmethyl)-1,4-diazepan-2-one (6R)-6-methoxy-1-[(4-methoxyphen…
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) | 1.00 | 5.55 | -39.22 | 2 | 7 | 1 | 72 | 345.423 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 3.35 | -13.13 | 1 | 7 | 0 | 71 | 344.415 | 6 | ↓ |