In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 14 | No |
Popular Name: 5-(aminomethyl)-N-methyl-N-[(3R)-tetrahydrothiophen-3-yl]thiazol-2-amine 5-(aminomethyl)-N-methyl-N-[(3R)…
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) | 1.16 | 4.03 | -46.5 | 3 | 3 | 1 | 44 | 230.382 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.16 | 3.63 | -5.39 | 2 | 3 | 0 | 42 | 229.374 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.