In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 14 | Yes |
Popular Name: [4-[[(3S)-3-methylpyrrolidin-1-yl]methyl]thiazol-2-yl]methanamine [4-[[(3S)-3-methylpyrrolidin-1-y…
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) | 0.70 | 3.44 | -93.72 | 4 | 3 | 2 | 45 | 213.35 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 3.04 | -31.79 | 3 | 3 | 1 | 43 | 212.342 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.