In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 21 | Yes |
Popular Name: 7-[[4-(1-amino-1-methyl-ethyl)triazol-1-yl]methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[4-(1-amino-1-methyl-ethyl)tr…
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) | 1.19 | 4.1 | -104.95 | 4 | 7 | 2 | 94 | 306.395 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 3.44 | -15.92 | 2 | 7 | 0 | 91 | 304.379 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.19 | 3.7 | -57.84 | 3 | 7 | 1 | 93 | 305.387 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.