In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 18 | Yes |
Popular Name: 1,2-ethanediamine, N'-(3-chlorophenyl)-N-methyl-N-phenyl- 1,2-ethanediamine, N'-(3-chlorop…
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) | 4.18 | 8.3 | -4.13 | 1 | 2 | 0 | 15 | 260.768 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.18 | 8.75 | -21.68 | 2 | 2 | 0 | 16 | 261.776 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.