In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2011 | 21 | Yes |
Popular Name: 1-[(3S)-1-isopropylpyrrolidin-3-yl]-N-[(1-methylbenzimidazol-2-yl)methyl]methanamine 1-[(3S)-1-isopropylpyrrolidin-3-…
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) | 2.37 | 7.9 | -38.37 | 2 | 4 | 1 | 34 | 287.431 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 8.34 | -75.29 | 3 | 4 | 2 | 36 | 288.439 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.