In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: (2S)-N-propyl-2-[[2-(2-pyridyl)thiazol-4-yl]methylamino]propanamide (2S)-N-propyl-2-[[2-(2-pyridyl)t…
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) | 1.75 | 4.13 | -43.27 | 3 | 5 | 1 | 71 | 305.427 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.75 | 2.88 | -16.21 | 2 | 5 | 0 | 67 | 304.419 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.