In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2009 | 35 | Yes |
Popular Name: 7-methyl-5-phenyl-1-[4-(4-phenylpiperazin-1-yl)butyl]-3H-1,4-benzodiazepin-2-one 7-methyl-5-phenyl-1-[4-(4-phenyl…
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) | 4.67 | 13.71 | -45.47 | 1 | 5 | 1 | 40 | 467.637 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.67 | 11.41 | -11.33 | 0 | 5 | 0 | 39 | 466.629 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.67 | 14.53 | -85.69 | 2 | 5 | 2 | 42 | 468.645 | 7 | ↓ |