In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (2S)-N-[3-(aminomethyl)phenyl]-2-[cyclopentyl(methyl)amino]propanamide (2S)-N-[3-(aminomethyl)phenyl]-2…
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) | 2.04 | 5.8 | -89.92 | 5 | 4 | 2 | 61 | 277.412 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 5.4 | -35.28 | 4 | 4 | 1 | 60 | 276.404 | 5 | ↓ |