In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: (3S)-1-[2,5-dimethyl-4-(propylaminomethyl)pyrazol-3-yl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[2,5-dimethyl-4-(propylam…
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) | 1.35 | 8.25 | -100.42 | 3 | 5 | 2 | 42 | 281.448 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 5.86 | -37.78 | 2 | 5 | 1 | 41 | 280.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.