In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1S)-2-ethyl-1-phenyl-N-(2-pyridylmethyl)butan-1-amine (1S)-2-ethyl-1-phenyl-N-(2-pyrid…
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) | 4.04 | 9.38 | -33.76 | 2 | 2 | 1 | 29 | 269.412 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.04 | 9.45 | -3.4 | 1 | 2 | 0 | 25 | 268.404 | 7 | ↓ |