In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (2S)-1-[3-[4-(aminomethyl)phenoxy]propyl]pyrrolidine-2-carboxamide (2S)-1-[3-[4-(aminomethyl)phenox…
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) | 1.16 | 2.77 | -91.95 | 6 | 5 | 2 | 84 | 279.384 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 1.27 | -79.27 | 5 | 5 | 1 | 88 | 278.376 | 7 | ↓ |