In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: N,N-diethyl-5-[[[(1S)-1-methyl-2-(1-piperidyl)ethyl]amino]methyl]thiazol-2-amine N,N-diethyl-5-[[[(1S)-1-methyl-2…
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) | 2.91 | 9.14 | -33.74 | 2 | 4 | 1 | 33 | 311.519 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 9.6 | -74.7 | 3 | 4 | 2 | 34 | 312.527 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 10.17 | -115.33 | 3 | 4 | 2 | 37 | 312.527 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 10.62 | -192.95 | 4 | 4 | 3 | 38 | 313.535 | 8 | ↓ |