In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 22 | Yes |
Popular Name: 5-(2-chlorophenyl)-1,3,6,7,8,9-hexahydrobenzothiopheno[2,3-e][1,4]diazepin-2-one 5-(2-chlorophenyl)-1,3,6,7,8,9-h…
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) | 3.77 | 6.42 | -8.6 | 1 | 3 | 0 | 41 | 330.84 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 7.37 | -29.5 | 2 | 3 | 1 | 43 | 331.848 | 1 | ↓ |