In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: (2S)-N2,2-dimethyl-N2-[(2-methylthiazol-4-yl)methyl]pentane-1,2-diamine (2S)-N2,2-dimethyl-N2-[(2-methyl…
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) | 1.30 | 2.62 | -37.5 | 3 | 3 | 1 | 44 | 242.412 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.30 | 4.5 | -110.24 | 4 | 3 | 2 | 45 | 243.42 | 6 | ↓ |