In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2010 | 18 | Yes |
Popular Name: [(3S)-3-(aminomethyl)pyrrolidin-1-yl]-(benzothiophen-3-yl)methanone [(3S)-3-(aminomethyl)pyrrolidin-…
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) | 1.11 | 4.82 | -53.81 | 3 | 3 | 1 | 48 | 261.37 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.