| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 13 | Yes |
Popular Name: (3S)-N1-methyl-N1-(thiazol-4-ylmethyl)butane-1,3-diamine (3S)-N1-methyl-N1-(thiazol-4-ylm…
| 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) | 0.39 | 0.62 | -44.07 | 3 | 3 | 1 | 44 | 200.331 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 0.32 | -4.63 | 2 | 3 | 0 | 42 | 199.323 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.39 | 2.95 | -109.02 | 4 | 3 | 2 | 45 | 201.339 | 5 | ↓ |
