In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2011 | 20 | Yes |
Popular Name: N-[2-[(3,4-dichlorophenyl)methoxy]phenyl]ethane-1,2-diamine N-[2-[(3,4-dichlorophenyl)methox…
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) | 3.49 | 5.83 | -47.43 | 4 | 3 | 1 | 49 | 312.22 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.49 | 5.45 | -4.85 | 3 | 3 | 0 | 47 | 311.212 | 6 | ↓ |