In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 20 | Yes |
Popular Name: 1-(3-bromo-4-propoxy-phenyl)-N-(3-pyridylmethyl)methanamine 1-(3-bromo-4-propoxy-phenyl)-N-(…
None
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) | 3.33 | 8.16 | -53.01 | 2 | 3 | 1 | 39 | 336.253 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 6.73 | -6.81 | 1 | 3 | 0 | 34 | 335.245 | 7 | ↓ |