In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | Yes |
Popular Name: 1-(2-tert-butylthiazol-5-yl)-N-[[(3R)-1-methylpyrrolidin-3-yl]methyl]methanamine 1-(2-tert-butylthiazol-5-yl)-N-[…
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) | 2.64 | 6.16 | -36.21 | 2 | 3 | 1 | 29 | 268.45 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.64 | 7.49 | -105.43 | 3 | 3 | 2 | 34 | 269.458 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.