In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: (1R)-N-[(4-bromophenyl)methyl]-1-(4-chloro-3-fluoro-phenyl)-N-methyl-ethane-1,2-diamine (1R)-N-[(4-bromophenyl)methyl]-1…
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) | 3.71 | 7.42 | -60.83 | 3 | 2 | 1 | 31 | 372.689 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.71 | 9.11 | -140.99 | 4 | 2 | 2 | 32 | 373.697 | 5 | ↓ |