In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 19 | Yes |
Popular Name: 1-(3-chloro-4-methoxy-phenyl)-N-[(4-fluorophenyl)methyl]methanamine 1-(3-chloro-4-methoxy-phenyl)-N-…
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) | 3.72 | 8.17 | -55.65 | 2 | 2 | 1 | 26 | 280.75 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.72 | 6.75 | -6.29 | 1 | 2 | 0 | 21 | 279.742 | 5 | ↓ |