In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 13 | Yes |
Popular Name: N-[(3-chloro-4-fluoro-phenyl)methyl]prop-2-en-1-amine N-[(3-chloro-4-fluoro-phenyl)met…
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) | 2.91 | 6.37 | -46.37 | 2 | 1 | 1 | 17 | 200.664 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 5 | -3.43 | 1 | 1 | 0 | 12 | 199.656 | 4 | ↓ |