In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2010 | 28 | Yes |
Popular Name: 3-[3-[[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]methyl]indol-1-yl]propanamide 3-[3-[[(4-methyl-5,6,7,8-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) | 1.91 | 7.94 | -43.95 | 4 | 6 | 1 | 90 | 378.5 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 6.57 | -13.86 | 3 | 6 | 0 | 86 | 377.492 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.