In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2011 | 20 | Yes |
Popular Name: 3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylic acid 3-(4-methylphenyl)-6,7,8,9-tetra…
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) | 3.70 | 9.5 | -64.35 | 0 | 4 | -1 | 58 | 269.324 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 9.92 | -31.89 | 1 | 4 | 0 | 59 | 270.332 | 2 | ↓ |