In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 20 | Yes |
Popular Name: N1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-benzene-1,3-diamine N1-(3,4-dihydro-2H-1,5-benzodiox…
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) | 3.57 | 5.39 | -6.53 | 3 | 4 | 0 | 57 | 270.332 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.