In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2011 | 20 | Yes |
Popular Name: N-[(2-tert-butylthiazol-5-yl)methyl]-1-[(3S)-1-isopropylpyrrolidin-3-yl]methanamine N-[(2-tert-butylthiazol-5-yl)met…
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) | 3.31 | 7.41 | -34.06 | 2 | 3 | 1 | 29 | 296.504 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 8.73 | -105.76 | 3 | 3 | 2 | 34 | 297.512 | 6 | ↓ |