In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: N-[(1S)-1-(2-indolin-1-ylthiazol-5-yl)ethyl]propan-1-amine N-[(1S)-1-(2-indolin-1-ylthiazol…
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) | 4.02 | 9.27 | -40.3 | 2 | 3 | 1 | 33 | 288.44 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.02 | 8.09 | -6.85 | 1 | 3 | 0 | 28 | 287.432 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.