In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2011 | 16 | Yes |
Popular Name: 4-[(Z)-(4-chlorodithiazol-5-ylidene)amino]-N,N-dimethyl-aniline 4-[(Z)-(4-chlorodithiazol-5-ylid…
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) | 4.04 | 6.32 | -3.64 | 0 | 3 | 0 | 28 | 271.798 | 2 | ↓ |
Ref Reference (pH 7) | 4.04 | 6 | -3.25 | 0 | 3 | 0 | 28 | 271.798 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.04 | 7.06 | -45.63 | 1 | 3 | 0 | 30 | 272.806 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.04 | 6.74 | -46.9 | 1 | 3 | 0 | 30 | 272.806 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.