In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 20 | No |
Popular Name: (1Z)-1-(3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylidene)-3-phenyl-thiourea (1Z)-1-(3-methyl-4,5,6,7-tetrahy…
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) | -0.33 | 11 | -27.17 | 2 | 3 | 1 | 28 | 304.464 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.34 | 10.57 | -10.55 | 1 | 3 | 0 | 29 | 303.456 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.