In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2007 | 30 | No |
Popular Name: N-(4,6-dimethylbenzothiazol-2-yl)-4-nitro-N-(3-pyridylmethyl)benzamide N-(4,6-dimethylbenzothiazol-2-yl…
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) | 4.55 | 1.23 | -18.47 | 0 | 7 | 0 | 91 | 418.478 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.55 | 1.34 | -57.01 | 1 | 7 | 1 | 93 | 419.486 | 5 | ↓ |