In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2010 | 17 | Yes |
Popular Name: (2S)-1-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-2-hydroxy-2-phenyl-ethanone (2S)-1-[(3R)-3-(aminomethyl)pyrr…
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) | -0.22 | 2.29 | -56.3 | 4 | 4 | 1 | 68 | 235.307 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.