In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 28 | No |
Popular Name: 1-[(3,5-dimethylphenyl)methyl]-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine 1-[(3,5-dimethylphenyl)methyl]-4…
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 | 8.01 | -12.73 | 0 | 7 | 0 | 86 | 403.504 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.70 | 10.21 | -57.76 | 1 | 7 | 1 | 88 | 404.512 | 5 | ↓ |