In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 17 | No |
Popular Name: (2S)-N1-tert-butyl-N2,3-dimethyl-N2-[(3R)-tetrahydrothiophen-3-yl]butane-1,2-diamine (2S)-N1-tert-butyl-N2,3-dimethyl…
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) | 3.07 | 6.48 | -33.15 | 2 | 2 | 1 | 20 | 259.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.07 | 5.29 | -1.7 | 1 | 2 | 0 | 15 | 258.475 | 6 | ↓ |