In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 21 | Yes |
Popular Name: 2-[[(3R)-3-(aminomethyl)pyrrolidine-1-carbonyl]amino]-3,5-dimethyl-benzoic 2-[[(3R)-3-(aminomethyl)pyrrolid…
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) | 0.90 | 5.56 | -83.34 | 4 | 6 | 0 | 100 | 291.351 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.