In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 19 | Yes |
Popular Name: (2R)-2-methyl-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-1,4-diazepan-5-one (2R)-2-methyl-1-[(5-methyl-1-pro…
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) | 0.79 | 5.24 | -47.09 | 2 | 5 | 1 | 51 | 265.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 3.23 | -11.61 | 1 | 5 | 0 | 50 | 264.373 | 4 | ↓ |