In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 20 | Yes |
Popular Name: N5-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-methyl-1,3-benzothiazole-5,6-diamine N5-[[(2S)-1-ethylpyrrolidin-2-yl…
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) | 2.13 | 5.09 | -40.18 | 4 | 4 | 1 | 55 | 291.444 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 2.75 | -8.24 | 3 | 4 | 0 | 54 | 290.436 | 4 | ↓ |