In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2011 | 21 | Yes |
Popular Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(1-propyltetrazol-5-yl)methanamine N-(1,3-benzothiazol-2-ylmethyl)-…
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) | 1.67 | 7.36 | -54.1 | 1 | 6 | 1 | 61 | 303.415 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 4.99 | -15.98 | 0 | 6 | 0 | 60 | 302.407 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.