In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2010 | 16 | Yes |
Popular Name: (2R)-N2,N2,4-trimethyl-N1-(thiazol-4-ylmethyl)pentane-1,2-diamine (2R)-N2,N2,4-trimethyl-N1-(thiaz…
None
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) | 2.34 | 6.52 | -112.69 | 3 | 3 | 2 | 34 | 243.42 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 4.02 | -3.02 | 1 | 3 | 0 | 28 | 241.404 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 4.05 | -38.36 | 2 | 3 | 1 | 33 | 242.412 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 4.81 | -32.74 | 2 | 3 | 1 | 29 | 242.412 | 7 | ↓ |