In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 16 | No |
Popular Name: 5-(aminomethyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-thiazol-2-amine 5-(aminomethyl)-N-[(3S)-1,1-diox…
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) | 0.04 | 0.28 | -55.56 | 3 | 5 | 1 | 78 | 262.38 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.04 | -0.12 | -14.07 | 2 | 5 | 0 | 76 | 261.372 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.