In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 17 | Yes |
Popular Name: 3-fluoro-N-[[(3S)-1-isopropylpyrrolidin-3-yl]methyl]pyridin-2-amine 3-fluoro-N-[[(3S)-1-isopropylpyr…
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) | 2.22 | 7.2 | -34.1 | 2 | 3 | 1 | 29 | 238.33 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.22 | 7.57 | -84.2 | 3 | 3 | 2 | 31 | 239.338 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.